ethyl 2-methyl-2-(2-methylidenecyclopentyl)-3-oxidanyl-3-[1-(phenylsulfonyl)pyrrol-3-yl]propanoate

Systemtic Name: ethyl 2-methyl-2-(2-methylidenecyclopentyl)-3-oxidanyl-3-[1-(phenylsulfonyl)pyrrol-3-yl]propanoate Openeye Name: ethyl 3-[1-(benzenesulfonyl)pyrrol-3-yl]-3-hydroxy-2-methyl-2-(2-methylenecyclopentyl)propanoate CAS Name: 3-[1-(benzenesulfonyl)-3-pyrrolyl]-3-hydroxy-2-methyl-2-(2-methylenecyclopentyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-[1-(benzenesulfonyl)pyrrol-3-yl]-3-hydroxy-2-methyl-2-(2-methylidenecyclopentyl)propanoate Traditional Name: 3-(1-besylpyrrol-3-yl)-3-hydroxy-2-methyl-2-(2-methylenecyclopentyl)propionic acid ethyl ester Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C1CCCC1=C)C(C2=CN(C=C2)S(=O)(=O)C3=CC=CC=C3)O

Isomeric SMILES

CCOC(=O)C(C)(C1CCCC1=C)C(C2=CN(C=C2)S(=O)(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C22H27NO5S/c1-4-28-21(25)22(3,19-12-8-9-16(19)2)20(24)17-13-14-23(15-17)29(26,27)18-10-6-5-7-11-18/h5-7,10-11,13-15,19-20,24H,2,4,8-9,12H2,1,3H3