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Organooxygen compounds

Organooxygen compounds

Organic compounds that contain one or more oxygen atoms.
Carbonyl compounds (36)
Enediols (14)
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1 – 15 of 31 results
1

Ethyl potassium malonate, 98%, Thermo Scientific Chemicals

CAS: 6148-64-7 Molecular Formula: C5H7KO4 Molecular Weight (g/mol): 170.2 MDL Number: MFCD00035603 InChI Key: WVUCPRGADMCTBN-UHFFFAOYSA-M Synonym: ethyl potassium malonate,potassium 3-ethoxy-3-oxopropanoate,potassium ethyl malonate,potassium monoethyl malonate,monoethyl malonate potassium salt,malonic acid monoethyl ester potassium salt,monoethyl potassium malonate,ethyl malonate potassium salt,propanedioic acid, monoethyl ester, potassium salt,ethylpotassiummalonate PubChem CID: 3446434 IUPAC Name: potassium;3-ethoxy-3-oxopropanoate SMILES: CCOC(=O)CC(=O)[O-].[K+]

PubChem CID 3446434
CAS 6148-64-7
Molecular Weight (g/mol) 170.2
MDL Number MFCD00035603
SMILES CCOC(=O)CC(=O)[O-].[K+]
Synonym ethyl potassium malonate,potassium 3-ethoxy-3-oxopropanoate,potassium ethyl malonate,potassium monoethyl malonate,monoethyl malonate potassium salt,malonic acid monoethyl ester potassium salt,monoethyl potassium malonate,ethyl malonate potassium salt,propanedioic acid, monoethyl ester, potassium salt,ethylpotassiummalonate
IUPAC Name potassium;3-ethoxy-3-oxopropanoate
InChI Key WVUCPRGADMCTBN-UHFFFAOYSA-M
Molecular Formula C5H7KO4
2

Ethyl potassium malonate, 98%, Thermo Scientific Chemicals

CAS: 6148-64-7 Molecular Formula: C5H7KO4 Molecular Weight (g/mol): 170.205 MDL Number: MFCD00035603 InChI Key: WVUCPRGADMCTBN-UHFFFAOYSA-M Synonym: ethyl potassium malonate,potassium 3-ethoxy-3-oxopropanoate,potassium ethyl malonate,potassium monoethyl malonate,monoethyl malonate potassium salt,malonic acid monoethyl ester potassium salt,monoethyl potassium malonate,ethyl malonate potassium salt,propanedioic acid, monoethyl ester, potassium salt,ethylpotassiummalonate PubChem CID: 3446434 IUPAC Name: potassium;3-ethoxy-3-oxopropanoate SMILES: CCOC(=O)CC(=O)[O-].[K+]

PubChem CID 3446434
CAS 6148-64-7
Molecular Weight (g/mol) 170.205
MDL Number MFCD00035603
SMILES CCOC(=O)CC(=O)[O-].[K+]
Synonym ethyl potassium malonate,potassium 3-ethoxy-3-oxopropanoate,potassium ethyl malonate,potassium monoethyl malonate,monoethyl malonate potassium salt,malonic acid monoethyl ester potassium salt,monoethyl potassium malonate,ethyl malonate potassium salt,propanedioic acid, monoethyl ester, potassium salt,ethylpotassiummalonate
IUPAC Name potassium;3-ethoxy-3-oxopropanoate
InChI Key WVUCPRGADMCTBN-UHFFFAOYSA-M
Molecular Formula C5H7KO4
3

Methyl potassium malonate, 98%, Thermo Scientific Chemicals

CAS: 38330-80-2 Molecular Formula: C4H5KO4 Molecular Weight (g/mol): 156.178 MDL Number: MFCD00014021 InChI Key: WWTULTKUWBKVGV-UHFFFAOYSA-M Synonym: potassium 3-methoxy-3-oxopropanoate,methyl potassium malonate,potassium methyl malonate,propanedioic acid, monomethyl ester, potassium salt,potassium monomethyl malonate,monomethyl malonate potassium salt,hydrogen methyl malonate potassium salt,monomethylpotassiummalonate,acmc-209vp4,ksc226a9d PubChem CID: 2724687 IUPAC Name: potassium;3-methoxy-3-oxopropanoate SMILES: COC(=O)CC(=O)[O-].[K+]

PubChem CID 2724687
CAS 38330-80-2
Molecular Weight (g/mol) 156.178
MDL Number MFCD00014021
SMILES COC(=O)CC(=O)[O-].[K+]
Synonym potassium 3-methoxy-3-oxopropanoate,methyl potassium malonate,potassium methyl malonate,propanedioic acid, monomethyl ester, potassium salt,potassium monomethyl malonate,monomethyl malonate potassium salt,hydrogen methyl malonate potassium salt,monomethylpotassiummalonate,acmc-209vp4,ksc226a9d
IUPAC Name potassium;3-methoxy-3-oxopropanoate
InChI Key WWTULTKUWBKVGV-UHFFFAOYSA-M
Molecular Formula C4H5KO4
4

Monoethyl Potassium Malonate 98.0+%, TCI America™

CAS: 6148-64-7 Molecular Formula: C5H7KO4 Molecular Weight (g/mol): 170.205 MDL Number: MFCD00035603 InChI Key: WVUCPRGADMCTBN-UHFFFAOYSA-M Synonym: ethyl potassium malonate,potassium 3-ethoxy-3-oxopropanoate,potassium ethyl malonate,potassium monoethyl malonate,monoethyl malonate potassium salt,malonic acid monoethyl ester potassium salt,monoethyl potassium malonate,ethyl malonate potassium salt,propanedioic acid, monoethyl ester, potassium salt,ethylpotassiummalonate PubChem CID: 3446434 IUPAC Name: potassium;3-ethoxy-3-oxopropanoate SMILES: CCOC(=O)CC(=O)[O-].[K+]

PubChem CID 3446434
CAS 6148-64-7
Molecular Weight (g/mol) 170.205
MDL Number MFCD00035603
SMILES CCOC(=O)CC(=O)[O-].[K+]
Synonym ethyl potassium malonate,potassium 3-ethoxy-3-oxopropanoate,potassium ethyl malonate,potassium monoethyl malonate,monoethyl malonate potassium salt,malonic acid monoethyl ester potassium salt,monoethyl potassium malonate,ethyl malonate potassium salt,propanedioic acid, monoethyl ester, potassium salt,ethylpotassiummalonate
IUPAC Name potassium;3-ethoxy-3-oxopropanoate
InChI Key WVUCPRGADMCTBN-UHFFFAOYSA-M
Molecular Formula C5H7KO4
5

Monomethyl Potassium Malonate 98.0+%, TCI America™

CAS: 38330-80-2 Molecular Formula: C4H5KO4 Molecular Weight (g/mol): 156.178 MDL Number: MFCD00014021 InChI Key: WWTULTKUWBKVGV-UHFFFAOYSA-M Synonym: potassium 3-methoxy-3-oxopropanoate,methyl potassium malonate,potassium methyl malonate,propanedioic acid, monomethyl ester, potassium salt,potassium monomethyl malonate,monomethyl malonate potassium salt,hydrogen methyl malonate potassium salt,monomethylpotassiummalonate,acmc-209vp4,ksc226a9d PubChem CID: 2724687 IUPAC Name: potassium;3-methoxy-3-oxopropanoate SMILES: COC(=O)CC(=O)[O-].[K+]

PubChem CID 2724687
CAS 38330-80-2
Molecular Weight (g/mol) 156.178
MDL Number MFCD00014021
SMILES COC(=O)CC(=O)[O-].[K+]
Synonym potassium 3-methoxy-3-oxopropanoate,methyl potassium malonate,potassium methyl malonate,propanedioic acid, monomethyl ester, potassium salt,potassium monomethyl malonate,monomethyl malonate potassium salt,hydrogen methyl malonate potassium salt,monomethylpotassiummalonate,acmc-209vp4,ksc226a9d
IUPAC Name potassium;3-methoxy-3-oxopropanoate
InChI Key WWTULTKUWBKVGV-UHFFFAOYSA-M
Molecular Formula C4H5KO4
6

Bromoacetaldehyde dimethyl acetal, 97+%, stab. with potassium carbonate, Thermo Scientific Chemicals

CAS: 7252-83-7 Molecular Formula: C4H9BrO2 Molecular Weight (g/mol): 169.018 MDL Number: MFCD00000213 InChI Key: FUSFWUFSEJXMRQ-UHFFFAOYSA-N Synonym: bromoacetaldehyde dimethyl acetal,ethane, 2-bromo-1,1-dimethoxy,2,2-dimethoxyethyl bromide,dimethylbromoacetal,1-bromo-2,2-dimethoxyethane,2,2-dimethoxybromoethane,2-bromoacetaldehyde dimethyl acetal,bromoacetoaldehyde dimethyl acetal,bromoacetaldehyde dimethylacetal,acetaldehyde, bromo-, dimethyl acetal PubChem CID: 81672 IUPAC Name: 2-bromo-1,1-dimethoxyethane SMILES: COC(CBr)OC

PubChem CID 81672
CAS 7252-83-7
Molecular Weight (g/mol) 169.018
MDL Number MFCD00000213
SMILES COC(CBr)OC
Synonym bromoacetaldehyde dimethyl acetal,ethane, 2-bromo-1,1-dimethoxy,2,2-dimethoxyethyl bromide,dimethylbromoacetal,1-bromo-2,2-dimethoxyethane,2,2-dimethoxybromoethane,2-bromoacetaldehyde dimethyl acetal,bromoacetoaldehyde dimethyl acetal,bromoacetaldehyde dimethylacetal,acetaldehyde, bromo-, dimethyl acetal
IUPAC Name 2-bromo-1,1-dimethoxyethane
InChI Key FUSFWUFSEJXMRQ-UHFFFAOYSA-N
Molecular Formula C4H9BrO2
7

Di-tert-butyl malonate, 98+%, stab. with potassium carbonate, Thermo Scientific Chemicals

CAS: 541-16-2 Molecular Formula: C11H20O4 Molecular Weight (g/mol): 216.277 MDL Number: MFCD00008810 InChI Key: CLPHAYNBNTVRDI-UHFFFAOYSA-N Synonym: di-tert-butyl malonate,malonic acid di-tert-butyl ester,propanedioic acid, bis 1,1-dimethylethyl ester,di-t-butylmalonate,di-t-butyl malonate,unii-7e9xwt9380,1,3-di-tert-butyl propanedioate,di tert-butyl malonate,tert-butyl 2-tert-butoxycarbonyl acetate,di-tert-butyl malonate, stab. with potassium carbonate PubChem CID: 68324 IUPAC Name: ditert-butyl propanedioate SMILES: CC(C)(C)OC(=O)CC(=O)OC(C)(C)C

PubChem CID 68324
CAS 541-16-2
Molecular Weight (g/mol) 216.277
MDL Number MFCD00008810
SMILES CC(C)(C)OC(=O)CC(=O)OC(C)(C)C
Synonym di-tert-butyl malonate,malonic acid di-tert-butyl ester,propanedioic acid, bis 1,1-dimethylethyl ester,di-t-butylmalonate,di-t-butyl malonate,unii-7e9xwt9380,1,3-di-tert-butyl propanedioate,di tert-butyl malonate,tert-butyl 2-tert-butoxycarbonyl acetate,di-tert-butyl malonate, stab. with potassium carbonate
IUPAC Name ditert-butyl propanedioate
InChI Key CLPHAYNBNTVRDI-UHFFFAOYSA-N
Molecular Formula C11H20O4
8

Diethylene glycol divinyl ether, 98%, stab. 0.1% potassium hydroxide, Thermo Scientific Chemicals

CAS: 764-99-8 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.197 MDL Number: MFCD00054610 InChI Key: SAMJGBVVQUEMGC-UHFFFAOYSA-N Synonym: diethylene glycol divinyl ether,divinylcarbitol,dvedeg,dvedeg russian,ether, bis 2-vinyloxy ethyl,ethene, 1,1'-oxybis 2,1-ethanediyloxy bis,3,6,9-trioxaundeca-1,10-diene,unii-abm90y2g95,divinyl ether diethylenglykolu,bis 2-vinyloxy ethyl ether PubChem CID: 12998 IUPAC Name: 1-ethenoxy-2-(2-ethenoxyethoxy)ethane SMILES: C=COCCOCCOC=C

PubChem CID 12998
CAS 764-99-8
Molecular Weight (g/mol) 158.197
MDL Number MFCD00054610
SMILES C=COCCOCCOC=C
Synonym diethylene glycol divinyl ether,divinylcarbitol,dvedeg,dvedeg russian,ether, bis 2-vinyloxy ethyl,ethene, 1,1'-oxybis 2,1-ethanediyloxy bis,3,6,9-trioxaundeca-1,10-diene,unii-abm90y2g95,divinyl ether diethylenglykolu,bis 2-vinyloxy ethyl ether
IUPAC Name 1-ethenoxy-2-(2-ethenoxyethoxy)ethane
InChI Key SAMJGBVVQUEMGC-UHFFFAOYSA-N
Molecular Formula C8H14O3
9

2-(2-Ethoxyethoxy)ethyl bromide, 98%, stab. with potassium carbonate, Thermo Scientific Chemicals

CAS: 54550-36-6 Molecular Formula: C6H13BrO2 Molecular Weight (g/mol): 197.072 MDL Number: MFCD00051920 InChI Key: UEDIWIFQWRXXJG-UHFFFAOYSA-N Synonym: 1-bromo-2-2-ethoxyethoxy ethane,2-2-ethoxyethoxy ethyl bromide,1-2-bromoethoxy-2-ethoxyethane,1-bromo-2-2-ethoxy-ethoxy-ethane,acmc-1axh5,1-bromo-3,6-dioxaoctane,1-2-ethoxyethoxy-2-bromoethane,1-ethoxy-2-2-bromoethoxy ethane,1-2-bromoethoxy-2-ethoxy-ethane,1-bromo 2-2-ethoxyethoxy-ethane PubChem CID: 7015324 IUPAC Name: 1-(2-bromoethoxy)-2-ethoxyethane SMILES: CCOCCOCCBr

PubChem CID 7015324
CAS 54550-36-6
Molecular Weight (g/mol) 197.072
MDL Number MFCD00051920
SMILES CCOCCOCCBr
Synonym 1-bromo-2-2-ethoxyethoxy ethane,2-2-ethoxyethoxy ethyl bromide,1-2-bromoethoxy-2-ethoxyethane,1-bromo-2-2-ethoxy-ethoxy-ethane,acmc-1axh5,1-bromo-3,6-dioxaoctane,1-2-ethoxyethoxy-2-bromoethane,1-ethoxy-2-2-bromoethoxy ethane,1-2-bromoethoxy-2-ethoxy-ethane,1-bromo 2-2-ethoxyethoxy-ethane
IUPAC Name 1-(2-bromoethoxy)-2-ethoxyethane
InChI Key UEDIWIFQWRXXJG-UHFFFAOYSA-N
Molecular Formula C6H13BrO2
10

Monomethyl monopotassium malonate, 98%, Thermo Scientific Chemicals

CAS: 38330-80-2 Molecular Formula: C4H5O4·K Molecular Weight (g/mol): 156.18 MDL Number: MFCD00014021 InChI Key: WWTULTKUWBKVGV-UHFFFAOYSA-M Synonym: potassium 3-methoxy-3-oxopropanoate,methyl potassium malonate,potassium methyl malonate,propanedioic acid, monomethyl ester, potassium salt,potassium monomethyl malonate,monomethyl malonate potassium salt,hydrogen methyl malonate potassium salt,monomethylpotassiummalonate,acmc-209vp4,ksc226a9d PubChem CID: 2724687 IUPAC Name: potassium;3-methoxy-3-oxopropanoate SMILES: COC(=O)CC(=O)[O-].[K+]

PubChem CID 2724687
CAS 38330-80-2
Molecular Weight (g/mol) 156.18
MDL Number MFCD00014021
SMILES COC(=O)CC(=O)[O-].[K+]
Synonym potassium 3-methoxy-3-oxopropanoate,methyl potassium malonate,potassium methyl malonate,propanedioic acid, monomethyl ester, potassium salt,potassium monomethyl malonate,monomethyl malonate potassium salt,hydrogen methyl malonate potassium salt,monomethylpotassiummalonate,acmc-209vp4,ksc226a9d
IUPAC Name potassium;3-methoxy-3-oxopropanoate
InChI Key WWTULTKUWBKVGV-UHFFFAOYSA-M
Molecular Formula C4H5O4·K
11

18-Crown-6, 99%, Thermo Scientific Chemicals

CAS: 17455-13-9 Molecular Formula: C12H24O6 Molecular Weight (g/mol): 264.32 MDL Number: MFCD00005113 InChI Key: XEZNGIUYQVAUSS-UHFFFAOYSA-N Synonym: 18-crown-6,18-crown-6 ether,ethylene oxide cyclic hexamer,18-crown-6-ether,unii-63j177nc5b,ccris 3587,18-crown 6-ether,1,4,7,10,13,16-hexanoxacyclooctadecane,18-crown-6/1,4,7,10,13,16-hexaoxacyclooctadecane PubChem CID: 28557 ChEBI: CHEBI:32397 IUPAC Name: 1,4,7,10,13,16-hexaoxacyclooctadecane SMILES: C1COCCOCCOCCOCCOCCO1

PubChem CID 28557
CAS 17455-13-9
Molecular Weight (g/mol) 264.32
ChEBI CHEBI:32397
MDL Number MFCD00005113
SMILES C1COCCOCCOCCOCCOCCO1
Synonym 18-crown-6,18-crown-6 ether,ethylene oxide cyclic hexamer,18-crown-6-ether,unii-63j177nc5b,ccris 3587,18-crown 6-ether,1,4,7,10,13,16-hexanoxacyclooctadecane,18-crown-6/1,4,7,10,13,16-hexaoxacyclooctadecane
IUPAC Name 1,4,7,10,13,16-hexaoxacyclooctadecane
InChI Key XEZNGIUYQVAUSS-UHFFFAOYSA-N
Molecular Formula C12H24O6
12

Ethacrynic acid

CAS: 58-54-8 Molecular Formula: C13H12Cl2O4 Molecular Weight (g/mol): 303.135 MDL Number: MFCD00056693 InChI Key: AVOLMBLBETYQHX-UHFFFAOYSA-N Synonym: ethacrynic acid,etacrynic acid,ethacrynate,etacrinic acid,hydromedin,edecrin,crinuryl,edecril,edecrina,endecril PubChem CID: 3278 ChEBI: CHEBI:4876 IUPAC Name: 2-[2,3-dichloro-4-(2-methylidenebutanoyl)phenoxy]acetic acid SMILES: CCC(=C)C(=O)C1=C(C(=C(C=C1)OCC(=O)O)Cl)Cl

PubChem CID 3278
CAS 58-54-8
Molecular Weight (g/mol) 303.135
ChEBI CHEBI:4876
MDL Number MFCD00056693
SMILES CCC(=C)C(=O)C1=C(C(=C(C=C1)OCC(=O)O)Cl)Cl
Synonym ethacrynic acid,etacrynic acid,ethacrynate,etacrinic acid,hydromedin,edecrin,crinuryl,edecril,edecrina,endecril
IUPAC Name 2-[2,3-dichloro-4-(2-methylidenebutanoyl)phenoxy]acetic acid
InChI Key AVOLMBLBETYQHX-UHFFFAOYSA-N
Molecular Formula C13H12Cl2O4
13

Psora 4, Tocris Bioscience™

CAS: 724709-68-6 Molecular Formula: C21H18O4 Molecular Weight (g/mol): 334.371 InChI Key: JJAWGNIQEOFURP-UHFFFAOYSA-N Synonym: psora-4,psora 4,5-4-phenylbutoxy psoralen,4-4-phenylbutoxy furo 3,2-g chromen-7-one,4-4-phenylbutoxy-7h-furo 3,2-g chromen-7-one,4-4-phenylbutoxy-7h-furo 3,2-g 1 benzopyran-7-one,lopac-p-9872,d01nck,d0h1ei,psora hplc PubChem CID: 6603977 IUPAC Name: 4-(4-phenylbutoxy)furo[3,2-g]chromen-7-one SMILES: C1=CC=C(C=C1)CCCCOC2=C3C=CC(=O)OC3=CC4=C2C=CO4

PubChem CID 6603977
CAS 724709-68-6
Molecular Weight (g/mol) 334.371
SMILES C1=CC=C(C=C1)CCCCOC2=C3C=CC(=O)OC3=CC4=C2C=CO4
Synonym psora-4,psora 4,5-4-phenylbutoxy psoralen,4-4-phenylbutoxy furo 3,2-g chromen-7-one,4-4-phenylbutoxy-7h-furo 3,2-g chromen-7-one,4-4-phenylbutoxy-7h-furo 3,2-g 1 benzopyran-7-one,lopac-p-9872,d01nck,d0h1ei,psora hplc
IUPAC Name 4-(4-phenylbutoxy)furo[3,2-g]chromen-7-one
InChI Key JJAWGNIQEOFURP-UHFFFAOYSA-N
Molecular Formula C21H18O4
14

E-4031 dihydrochloride, Tocris Bioscience™

CAS: 113559-13-0 Molecular Formula: C21H29Cl2N3O3S Molecular Weight (g/mol): 474.44 MDL Number: MFCD01754739 InChI Key: ZQBNWMFBOSOOLX-UHFFFAOYSA-N Synonym: e-4031 dihydrochloride,1-2-6-methyl-2-pyridyl ethyl-4-4-methylsulfonylaminobenzoyl piperidine dihydrochloride,methanesulfonamide, n-4-1-2-6-methyl-2-pyridinyl ethyl-4-piperidinyl carbonyl phenyl-,dihydrochloride,n-4-1-2-6-methyl-2-pyridinyl ethyl-4-piperidinyl carbonyl phenyl methanesulfonamide dihydrochloride,n-4-1-2-6-methylpyridin-2-yl ethyl piperidine-4-carbonyl phenyl methanesulfonamide dihydrochloride,e-4031 free,c21h27n3o3s.2clh PubChem CID: 3087190 IUPAC Name: dihydrogen N-(4-{1-[2-(6-methylpyridin-2-yl)ethyl]piperidine-4-carbonyl}phenyl)methanesulfonamide dichloride SMILES: [H+].[H+].[Cl-].[Cl-].CC1=CC=CC(CCN2CCC(CC2)C(=O)C2=CC=C(NS(C)(=O)=O)C=C2)=N1

PubChem CID 3087190
CAS 113559-13-0
Molecular Weight (g/mol) 474.44
MDL Number MFCD01754739
SMILES [H+].[H+].[Cl-].[Cl-].CC1=CC=CC(CCN2CCC(CC2)C(=O)C2=CC=C(NS(C)(=O)=O)C=C2)=N1
Synonym e-4031 dihydrochloride,1-2-6-methyl-2-pyridyl ethyl-4-4-methylsulfonylaminobenzoyl piperidine dihydrochloride,methanesulfonamide, n-4-1-2-6-methyl-2-pyridinyl ethyl-4-piperidinyl carbonyl phenyl-,dihydrochloride,n-4-1-2-6-methyl-2-pyridinyl ethyl-4-piperidinyl carbonyl phenyl methanesulfonamide dihydrochloride,n-4-1-2-6-methylpyridin-2-yl ethyl piperidine-4-carbonyl phenyl methanesulfonamide dihydrochloride,e-4031 free,c21h27n3o3s.2clh
IUPAC Name dihydrogen N-(4-{1-[2-(6-methylpyridin-2-yl)ethyl]piperidine-4-carbonyl}phenyl)methanesulfonamide dichloride
InChI Key ZQBNWMFBOSOOLX-UHFFFAOYSA-N
Molecular Formula C21H29Cl2N3O3S
15

DCPIB, Tocris Bioscience™

CAS: 82749-70-0 Molecular Formula: C22H28Cl2O4 Molecular Weight (g/mol): 427.362 InChI Key: KHKGTPJPBOQECW-UHFFFAOYSA-N Synonym: SN-401,4-2-butyl-6,7-dichlor-2-cyclopentyl-indan-1-on-5-yl oxybutyric acid,d0j3qc,4-2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-3h-inden-5-yl oxy butanoic acid,4-2-butyl-6,7-dichloro-2-cyclopentylindan-1-on-5-yl oxybutyric acid,4-2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-2,3-dihydro-1h-inden-5-yl oxy butanoic acid,4-2-butyl-6,7-dichloro-2-cyclopentyl-2,3-dihydro-1-oxo-1h-inden-5-yl oxy butanoic acid,+ 4-2-butyl-6,7-dichloro-2-cyclopentyl-2,3-dihydro-1-oxo-1h-inden-5-yl oxy butanoic acid,-4-2-butyl-6,7-dichloro-2-cyclopentyl-2,3-dihydro-1-oxo-1h-inden-5-yl oxy butanoic acid PubChem CID: 10071166 IUPAC Name: 4-[(2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-3H-inden-5-yl)oxy]butanoic acid SMILES: CCCCC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OCCCC(=O)O)C3CCCC3

PubChem CID 10071166
CAS 82749-70-0
Molecular Weight (g/mol) 427.362
SMILES CCCCC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OCCCC(=O)O)C3CCCC3
Synonym SN-401,4-2-butyl-6,7-dichlor-2-cyclopentyl-indan-1-on-5-yl oxybutyric acid,d0j3qc,4-2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-3h-inden-5-yl oxy butanoic acid,4-2-butyl-6,7-dichloro-2-cyclopentylindan-1-on-5-yl oxybutyric acid,4-2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-2,3-dihydro-1h-inden-5-yl oxy butanoic acid,4-2-butyl-6,7-dichloro-2-cyclopentyl-2,3-dihydro-1-oxo-1h-inden-5-yl oxy butanoic acid,+ 4-2-butyl-6,7-dichloro-2-cyclopentyl-2,3-dihydro-1-oxo-1h-inden-5-yl oxy butanoic acid,-4-2-butyl-6,7-dichloro-2-cyclopentyl-2,3-dihydro-1-oxo-1h-inden-5-yl oxy butanoic acid
IUPAC Name 4-[(2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-3H-inden-5-yl)oxy]butanoic acid
InChI Key KHKGTPJPBOQECW-UHFFFAOYSA-N
Molecular Formula C22H28Cl2O4