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

Systemtic Name: methyl 2-(2-methylidenecyclopentyl)-3-oxidanyl-3-[1-(phenylsulfonyl)pyrrol-3-yl]propanoate Openeye Name: methyl 3-[1-(benzenesulfonyl)pyrrol-3-yl]-3-hydroxy-2-(2-methylenecyclopentyl)propanoate CAS Name: 3-[1-(benzenesulfonyl)-3-pyrrolyl]-3-hydroxy-2-(2-methylenecyclopentyl)propanoic acid methyl ester IUPAC Name: methyl 3-[1-(benzenesulfonyl)pyrrol-3-yl]-3-hydroxy-2-(2-methylidenecyclopentyl)propanoate Traditional Name: 3-(1-besylpyrrol-3-yl)-3-hydroxy-2-(2-methylenecyclopentyl)propionic acid methyl ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO5S/c1-14-7-6-10-17(14)18(20(23)26-2)19(22)15-11-12-21(13-15)27(24,25)16-8-4-3-5-9-16/h3-5,8-9,11-13,17-19,22H,1,6-7,10H2,2H3