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

Systemtic Name: 5-(4-methoxyphenyl)-2-methyl-4-(4-nitrophenyl)carbonyl-1-(phenylcarbamoyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 5-(4-methoxyphenyl)-2-methyl-4-(4-nitrobenzoyl)-1-(phenylcarbamoyl)-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[anilino(oxo)methyl]-5-(4-methoxyphenyl)-2-methyl-4-[(4-nitrophenyl)-oxomethyl]-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(4-methoxyphenyl)-2-methyl-4-(4-nitrobenzoyl)-1-(phenylcarbamoyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 5-(4-methoxyphenyl)-2-methyl-4-(4-nitrobenzoyl)-1-(phenylcarbamoyl)-3-(2-thienyl)proline Formula: C31H27N3O7S MolecularWeight: 585.62698

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C(N1C(=O)NC2=CC=CC=C2)C3=CC=C(C=C3)OC)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CS5)C(=O)O

Isomeric SMILES

CC1(C(C(C(N1C(=O)NC2=CC=CC=C2)C3=CC=C(C=C3)OC)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CS5)C(=O)O

InChI

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