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

Systemtic Name: methyl 3-oxidanyl-2-(2-oxidanylidenecyclopentyl)-3-[1-(phenylsulfonyl)pyrrol-3-yl]propanoate Openeye Name: methyl 3-[1-(benzenesulfonyl)pyrrol-3-yl]-3-hydroxy-2-(2-oxocyclopentyl)propanoate CAS Name: 3-[1-(benzenesulfonyl)-3-pyrrolyl]-3-hydroxy-2-(2-oxocyclopentyl)propanoic acid methyl ester IUPAC Name: methyl 3-[1-(benzenesulfonyl)pyrrol-3-yl]-3-hydroxy-2-(2-oxocyclopentyl)propanoate Traditional Name: 3-(1-besylpyrrol-3-yl)-3-hydroxy-2-(2-ketocyclopentyl)propionic acid methyl ester Formula: C19H21NO6S MolecularWeight: 391.43814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO6S/c1-26-19(23)17(15-8-5-9-16(15)21)18(22)13-10-11-20(12-13)27(24,25)14-6-3-2-4-7-14/h2-4,6-7,10-12,15,17-18,22H,5,8-9H2,1H3