2-methyl-5-(4-methylphenyl)-4-(4-nitrophenyl)carbonyl-1-(phenylcarbonyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: 2-methyl-5-(4-methylphenyl)-4-(4-nitrophenyl)carbonyl-1-(phenylcarbonyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 1-benzoyl-2-methyl-4-(4-nitrobenzoyl)-5-(p-tolyl)-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 1-benzoyl-2-methyl-5-(4-methylphenyl)-4-[(4-nitrophenyl)-oxomethyl]-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-benzoyl-2-methyl-5-(4-methylphenyl)-4-(4-nitrobenzoyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 1-benzoyl-2-methyl-4-(4-nitrobenzoyl)-5-(p-tolyl)-3-(2-thienyl)proline Formula: C31H26N2O6S MolecularWeight: 554.61294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(C(N2C(=O)C3=CC=CC=C3)(C)C(=O)O)C4=CC=CS4)C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2C(C(C(N2C(=O)C3=CC=CC=C3)(C)C(=O)O)C4=CC=CS4)C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C31H26N2O6S/c1-19-10-12-20(13-11-19)27-25(28(34)21-14-16-23(17-15-21)33(38)39)26(24-9-6-18-40-24)31(2,30(36)37)32(27)29(35)22-7-4-3-5-8-22/h3-18,25-27H,1-2H3,(H,36,37)