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

Systemtic Name: methyl 2-(2-methylidenecyclopentyl)-3-oxidanylidene-3-[1-(phenylsulfonyl)pyrrol-3-yl]propanoate Openeye Name: methyl 3-[1-(benzenesulfonyl)pyrrol-3-yl]-2-(2-methylenecyclopentyl)-3-oxo-propanoate CAS Name: 3-[1-(benzenesulfonyl)-3-pyrrolyl]-2-(2-methylenecyclopentyl)-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-[1-(benzenesulfonyl)pyrrol-3-yl]-2-(2-methylidenecyclopentyl)-3-oxopropanoate Traditional Name: 3-(1-besylpyrrol-3-yl)-3-keto-2-(2-methylenecyclopentyl)propionic acid methyl ester Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO5S/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/h3-5,8-9,11-13,17-18H,1,6-7,10H2,2H3