5-(4-chlorophenyl)-1-cyclobutylcarbonyl-3-(4-fluorophenyl)-2-methyl-4-(3-methylphenyl)carbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(4-chlorophenyl)-1-cyclobutylcarbonyl-3-(4-fluorophenyl)-2-methyl-4-(3-methylphenyl)carbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 5-(4-chlorophenyl)-1-(cyclobutanecarbonyl)-3-(4-fluorophenyl)-2-methyl-4-(3-methylbenzoyl)pyrrolidine-2-carboxylic acid CAS Name: 5-(4-chlorophenyl)-1-[cyclobutyl(oxo)methyl]-3-(4-fluorophenyl)-2-methyl-4-[(3-methylphenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(4-chlorophenyl)-1-(cyclobutanecarbonyl)-3-(4-fluorophenyl)-2-methyl-4-(3-methylbenzoyl)pyrrolidine-2-carboxylic acid Traditional Name: 5-(4-chlorophenyl)-1-(cyclobutanecarbonyl)-3-(4-fluorophenyl)-2-methyl-4-m-toluoyl-proline Formula: C31H29ClFNO4 MolecularWeight: 534.017663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C2C(C(N(C2C3=CC=C(C=C3)Cl)C(=O)C4CCC4)(C)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)Cl)C(=O)C4CCC4)(C)C(=O)O)C5=CC=C(C=C5)F

InChI

InChI=1S/C31H29ClFNO4/c1-18-5-3-8-22(17-18)28(35)25-26(19-11-15-24(33)16-12-19)31(2,30(37)38)34(29(36)21-6-4-7-21)27(25)20-9-13-23(32)14-10-20/h3,5,8-17,21,25-27H,4,6-7H2,1-2H3,(H,37,38)