5-(4-cyanophenyl)-1-cyclopentylcarbonyl-3-(4-fluorophenyl)-4-(3-methylphenyl)carbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(4-cyanophenyl)-1-cyclopentylcarbonyl-3-(4-fluorophenyl)-4-(3-methylphenyl)carbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 5-(4-cyanophenyl)-1-(cyclopentanecarbonyl)-3-(4-fluorophenyl)-4-(3-methylbenzoyl)pyrrolidine-2-carboxylic acid CAS Name: 5-(4-cyanophenyl)-1-[cyclopentyl(oxo)methyl]-3-(4-fluorophenyl)-4-[(3-methylphenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(4-cyanophenyl)-1-(cyclopentanecarbonyl)-3-(4-fluorophenyl)-4-(3-methylbenzoyl)pyrrolidine-2-carboxylic acid Traditional Name: 5-(4-cyanophenyl)-1-(cyclopentanecarbonyl)-3-(4-fluorophenyl)-4-m-toluoyl-proline Formula: C32H29FN2O4 MolecularWeight: 524.582063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C2C(C(N(C2C3=CC=C(C=C3)C#N)C(=O)C4CCCC4)C(=O)O)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)C2C(C(N(C2C3=CC=C(C=C3)C#N)C(=O)C4CCCC4)C(=O)O)C5=CC=C(C=C5)F

InChI

InChI=1S/C32H29FN2O4/c1-19-5-4-8-24(17-19)30(36)27-26(21-13-15-25(33)16-14-21)29(32(38)39)35(31(37)23-6-2-3-7-23)28(27)22-11-9-20(18-34)10-12-22/h4-5,8-17,23,26-29H,2-3,6-7H2,1H3,(H,38,39)