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

Systemtic Name: methyl 1-(4-chlorophenyl)sulfonyl-5-[(4-methylphenyl)methylcarbamoyl]-2-(2-nitrophenyl)pyrrolidine-3-carboxylate Openeye Name: methyl 1-(4-chlorophenyl)sulfonyl-2-(2-nitrophenyl)-5-(p-tolylmethylcarbamoyl)pyrrolidine-3-carboxylate CAS Name: 1-(4-chlorophenyl)sulfonyl-5-[[(4-methylphenyl)methylamino]-oxomethyl]-2-(2-nitrophenyl)-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-chlorophenyl)sulfonyl-5-[(4-methylphenyl)methylcarbamoyl]-2-(2-nitrophenyl)pyrrolidine-3-carboxylate Traditional Name: 1-(4-chlorophenyl)sulfonyl-5-[(4-methylbenzyl)carbamoyl]-2-(2-nitrophenyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C27H26ClN3O7S MolecularWeight: 572.02924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=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

CC1=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/C27H26ClN3O7S/c1-17-7-9-18(10-8-17)16-29-26(32)24-15-22(27(33)38-2)25(21-5-3-4-6-23(21)31(34)35)30(24)39(36,37)20-13-11-19(28)12-14-20/h3-14,22,24-25H,15-16H2,1-2H3,(H,29,32)