3-(4-chlorophenyl)-2-(3-methoxyphenyl)-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxylic acid

Systemtic Name: 3-(4-chlorophenyl)-2-(3-methoxyphenyl)-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxylic acid Openeye Name: 1-benzyl-3-(4-chlorophenyl)-2-(3-methoxyphenyl)-5-oxo-pyrrolidine-3-carboxylic acid CAS Name: 3-(4-chlorophenyl)-2-(3-methoxyphenyl)-5-oxo-1-(phenylmethyl)-3-pyrrolidinecarboxylic acid IUPAC Name: 1-benzyl-3-(4-chlorophenyl)-2-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid Traditional Name: 1-benzyl-3-(4-chlorophenyl)-5-keto-2-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid Formula: C25H22ClNO4 MolecularWeight: 435.89948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2C(CC(=O)N2CC3=CC=CC=C3)(C4=CC=C(C=C4)Cl)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C2C(CC(=O)N2CC3=CC=CC=C3)(C4=CC=C(C=C4)Cl)C(=O)O

InChI

InChI=1S/C25H22ClNO4/c1-31-21-9-5-8-18(14-21)23-25(24(29)30,19-10-12-20(26)13-11-19)15-22(28)27(23)16-17-6-3-2-4-7-17/h2-14,23H,15-16H2,1H3,(H,29,30)