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

Systemtic Name: 5-(4-chlorophenyl)-1-cyclohexylcarbonyl-3-(4-fluorophenyl)-2-methyl-4-(3-methylphenyl)carbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 5-(4-chlorophenyl)-1-(cyclohexanecarbonyl)-3-(4-fluorophenyl)-2-methyl-4-(3-methylbenzoyl)pyrrolidine-2-carboxylic acid CAS Name: 5-(4-chlorophenyl)-1-[cyclohexyl(oxo)methyl]-3-(4-fluorophenyl)-2-methyl-4-[(3-methylphenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(4-chlorophenyl)-1-(cyclohexanecarbonyl)-3-(4-fluorophenyl)-2-methyl-4-(3-methylbenzoyl)pyrrolidine-2-carboxylic acid Traditional Name: 5-(4-chlorophenyl)-1-(cyclohexanecarbonyl)-3-(4-fluorophenyl)-2-methyl-4-m-toluoyl-proline Formula: C33H33ClFNO4 MolecularWeight: 562.070823

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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)C4CCCCC4)(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)C4CCCCC4)(C)C(=O)O)C5=CC=C(C=C5)F

InChI

InChI=1S/C33H33ClFNO4/c1-20-7-6-10-24(19-20)30(37)27-28(21-13-17-26(35)18-14-21)33(2,32(39)40)36(31(38)23-8-4-3-5-9-23)29(27)22-11-15-25(34)16-12-22/h6-7,10-19,23,27-29H,3-5,8-9H2,1-2H3,(H,39,40)