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

Systemtic Name: methyl 2-(4-chlorophenyl)-1-(3-methylbutanoyl)-5-[(4-methylphenyl)methylcarbamoyl]pyrrolidine-3-carboxylate Openeye Name: methyl 2-(4-chlorophenyl)-1-(3-methylbutanoyl)-5-(p-tolylmethylcarbamoyl)pyrrolidine-3-carboxylate CAS Name: 2-(4-chlorophenyl)-1-(3-methyl-1-oxobutyl)-5-[[(4-methylphenyl)methylamino]-oxomethyl]-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-chlorophenyl)-1-(3-methylbutanoyl)-5-[(4-methylphenyl)methylcarbamoyl]pyrrolidine-3-carboxylate Traditional Name: 2-(4-chlorophenyl)-1-isovaleryl-5-[(4-methylbenzyl)carbamoyl]pyrrolidine-3-carboxylic acid methyl ester Formula: C26H31ClN2O4 MolecularWeight: 470.98834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CC(C(N2C(=O)CC(C)C)C3=CC=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2CC(C(N2C(=O)CC(C)C)C3=CC=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C26H31ClN2O4/c1-16(2)13-23(30)29-22(25(31)28-15-18-7-5-17(3)6-8-18)14-21(26(32)33-4)24(29)19-9-11-20(27)12-10-19/h5-12,16,21-22,24H,13-15H2,1-4H3,(H,28,31)