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

Systemtic Name: 5-(4-methoxyphenyl)-1-[(4-methylphenyl)carbamoyl]-4-(4-nitrophenyl)carbonyl-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 5-(4-methoxyphenyl)-4-(4-nitrobenzoyl)-1-(p-tolylcarbamoyl)-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 5-(4-methoxyphenyl)-1-[(4-methylanilino)-oxomethyl]-4-[(4-nitrophenyl)-oxomethyl]-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(4-methoxyphenyl)-1-[(4-methylphenyl)carbamoyl]-4-(4-nitrobenzoyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 5-(4-methoxyphenyl)-4-(4-nitrobenzoyl)-1-(p-tolylcarbamoyl)-3-(2-thienyl)proline Formula: C31H27N3O7S MolecularWeight: 585.62698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N2C(C(C(C2C(=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(C2C(=O)O)C3=CC=CS3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=C(C=C5)OC

InChI

InChI=1S/C31H27N3O7S/c1-18-5-11-21(12-6-18)32-31(38)33-27(19-9-15-23(41-2)16-10-19)26(25(28(33)30(36)37)24-4-3-17-42-24)29(35)20-7-13-22(14-8-20)34(39)40/h3-17,25-28H,1-2H3,(H,32,38)(H,36,37)