5-(3-methylphenyl)-4-(4-methylphenyl)carbonyl-1-(2-phenoxyethanoyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(3-methylphenyl)-4-(4-methylphenyl)carbonyl-1-(2-phenoxyethanoyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 4-(4-methylbenzoyl)-5-(m-tolyl)-1-(2-phenoxyacetyl)-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 5-(3-methylphenyl)-4-[(4-methylphenyl)-oxomethyl]-1-(1-oxo-2-phenoxyethyl)-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(4-methylbenzoyl)-5-(3-methylphenyl)-1-(2-phenoxyacetyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 5-(m-tolyl)-1-(2-phenoxyacetyl)-4-p-toluoyl-3-(2-thienyl)proline Formula: C32H29NO5S MolecularWeight: 539.64136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2C(C(N(C2C3=CC(=CC=C3)C)C(=O)COC4=CC=CC=C4)C(=O)O)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2C(C(N(C2C3=CC(=CC=C3)C)C(=O)COC4=CC=CC=C4)C(=O)O)C5=CC=CS5

InChI

InChI=1S/C32H29NO5S/c1-20-13-15-22(16-14-20)31(35)28-27(25-12-7-17-39-25)30(32(36)37)33(29(28)23-9-6-8-21(2)18-23)26(34)19-38-24-10-4-3-5-11-24/h3-18,27-30H,19H2,1-2H3,(H,36,37)