3-(4-fluorophenyl)-4-(3-methylphenyl)carbonyl-1-(phenylcarbamoyl)-5-pyridin-3-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: 3-(4-fluorophenyl)-4-(3-methylphenyl)carbonyl-1-(phenylcarbamoyl)-5-pyridin-3-yl-pyrrolidine-2-carboxylic acid Openeye Name: 3-(4-fluorophenyl)-4-(3-methylbenzoyl)-1-(phenylcarbamoyl)-5-(3-pyridyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[anilino(oxo)methyl]-3-(4-fluorophenyl)-4-[(3-methylphenyl)-oxomethyl]-5-(3-pyridinyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(4-fluorophenyl)-4-(3-methylbenzoyl)-1-(phenylcarbamoyl)-5-pyridin-3-ylpyrrolidine-2-carboxylic acid Traditional Name: 3-(4-fluorophenyl)-4-m-toluoyl-1-(phenylcarbamoyl)-5-(3-pyridyl)proline Formula: C31H26FN3O4 MolecularWeight: 523.554243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C2C(C(N(C2C3=CN=CC=C3)C(=O)NC4=CC=CC=C4)C(=O)O)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)C2C(C(N(C2C3=CN=CC=C3)C(=O)NC4=CC=CC=C4)C(=O)O)C5=CC=C(C=C5)F

InChI

InChI=1S/C31H26FN3O4/c1-19-7-5-8-21(17-19)29(36)26-25(20-12-14-23(32)15-13-20)28(30(37)38)35(27(26)22-9-6-16-33-18-22)31(39)34-24-10-3-2-4-11-24/h2-18,25-28H,1H3,(H,34,39)(H,37,38)