methyl 1-(4-chlorophenyl)sulfonyl-5-[(4-methoxyphenyl)methylcarbamoyl]-2-(3-nitrophenyl)pyrrolidine-3-carboxylate

Systemtic Name: methyl 1-(4-chlorophenyl)sulfonyl-5-[(4-methoxyphenyl)methylcarbamoyl]-2-(3-nitrophenyl)pyrrolidine-3-carboxylate Openeye Name: methyl 1-(4-chlorophenyl)sulfonyl-5-[(4-methoxyphenyl)methylcarbamoyl]-2-(3-nitrophenyl)pyrrolidine-3-carboxylate CAS Name: 1-(4-chlorophenyl)sulfonyl-5-[[(4-methoxyphenyl)methylamino]-oxomethyl]-2-(3-nitrophenyl)-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-chlorophenyl)sulfonyl-5-[(4-methoxyphenyl)methylcarbamoyl]-2-(3-nitrophenyl)pyrrolidine-3-carboxylate Traditional Name: 1-(4-chlorophenyl)sulfonyl-2-(3-nitrophenyl)-5-(p-anisylcarbamoyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C27H26ClN3O8S MolecularWeight: 588.02864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2CC(C(N2S(=O)(=O)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2CC(C(N2S(=O)(=O)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C27H26ClN3O8S/c1-38-21-10-6-17(7-11-21)16-29-26(32)24-15-23(27(33)39-2)25(18-4-3-5-20(14-18)31(34)35)30(24)40(36,37)22-12-8-19(28)9-13-22/h3-14,23-25H,15-16H2,1-2H3,(H,29,32)