5-(4-methoxyphenyl)-2-methyl-1-[(4-methylphenyl)carbamoyl]-4-(4-nitrophenyl)carbonyl-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(4-methoxyphenyl)-2-methyl-1-[(4-methylphenyl)carbamoyl]-4-(4-nitrophenyl)carbonyl-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 5-(4-methoxyphenyl)-2-methyl-4-(4-nitrobenzoyl)-1-(p-tolylcarbamoyl)-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 5-(4-methoxyphenyl)-2-methyl-1-[(4-methylanilino)-oxomethyl]-4-[(4-nitrophenyl)-oxomethyl]-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(4-methoxyphenyl)-2-methyl-1-[(4-methylphenyl)carbamoyl]-4-(4-nitrobenzoyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 5-(4-methoxyphenyl)-2-methyl-4-(4-nitrobenzoyl)-1-(p-tolylcarbamoyl)-3-(2-thienyl)proline Formula: C32H29N3O7S MolecularWeight: 599.65356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N2C(C(C(C2(C)C(=O)O)C3=CC=CS3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N2C(C(C(C2(C)C(=O)O)C3=CC=CS3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=C(C=C5)OC

InChI

InChI=1S/C32H29N3O7S/c1-19-6-12-22(13-7-19)33-31(39)34-28(20-10-16-24(42-3)17-11-20)26(29(36)21-8-14-23(15-9-21)35(40)41)27(25-5-4-18-43-25)32(34,2)30(37)38/h4-18,26-28H,1-3H3,(H,33,39)(H,37,38)