2-methyl-5-(4-methylphenyl)-3-(4-nitrophenyl)-4-(phenylcarbonyl)-1-(propan-2-ylcarbamoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 2-methyl-5-(4-methylphenyl)-3-(4-nitrophenyl)-4-(phenylcarbonyl)-1-(propan-2-ylcarbamoyl)pyrrolidine-2-carboxylic acid Openeye Name: 4-benzoyl-1-(isopropylcarbamoyl)-2-methyl-3-(4-nitrophenyl)-5-(p-tolyl)pyrrolidine-2-carboxylic acid CAS Name: 4-benzoyl-2-methyl-5-(4-methylphenyl)-3-(4-nitrophenyl)-1-[oxo-(propan-2-ylamino)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-benzoyl-2-methyl-5-(4-methylphenyl)-3-(4-nitrophenyl)-1-(propan-2-ylcarbamoyl)pyrrolidine-2-carboxylic acid Traditional Name: 4-benzoyl-1-(isopropylcarbamoyl)-2-methyl-3-(4-nitrophenyl)-5-(p-tolyl)proline Formula: C30H31N3O6 MolecularWeight: 529.58364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(C(N2C(=O)NC(C)C)(C)C(=O)O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2C(C(C(N2C(=O)NC(C)C)(C)C(=O)O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=CC=C4

InChI

InChI=1S/C30H31N3O6/c1-18(2)31-29(37)32-26(21-12-10-19(3)11-13-21)24(27(34)22-8-6-5-7-9-22)25(30(32,4)28(35)36)20-14-16-23(17-15-20)33(38)39/h5-18,24-26H,1-4H3,(H,31,37)(H,35,36)