methyl 1-cyclohexylcarbonyl-2-(3,4-dichlorophenyl)-5-[(4-fluorophenyl)methylcarbamoyl]-4-phenyl-pyrrolidine-3-carboxylate

Systemtic Name: methyl 1-cyclohexylcarbonyl-2-(3,4-dichlorophenyl)-5-[(4-fluorophenyl)methylcarbamoyl]-4-phenyl-pyrrolidine-3-carboxylate Openeye Name: methyl 1-(cyclohexanecarbonyl)-2-(3,4-dichlorophenyl)-5-[(4-fluorophenyl)methylcarbamoyl]-4-phenyl-pyrrolidine-3-carboxylate CAS Name: 1-[cyclohexyl(oxo)methyl]-2-(3,4-dichlorophenyl)-5-[[(4-fluorophenyl)methylamino]-oxomethyl]-4-phenyl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(cyclohexanecarbonyl)-2-(3,4-dichlorophenyl)-5-[(4-fluorophenyl)methylcarbamoyl]-4-phenylpyrrolidine-3-carboxylate Traditional Name: 1-(cyclohexanecarbonyl)-2-(3,4-dichlorophenyl)-5-[(4-fluorobenzyl)carbamoyl]-4-phenyl-pyrrolidine-3-carboxylic acid methyl ester Formula: C33H33Cl2FN2O4 MolecularWeight: 611.530523

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(N(C1C2=CC(=C(C=C2)Cl)Cl)C(=O)C3CCCCC3)C(=O)NCC4=CC=C(C=C4)F)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1C(C(N(C1C2=CC(=C(C=C2)Cl)Cl)C(=O)C3CCCCC3)C(=O)NCC4=CC=C(C=C4)F)C5=CC=CC=C5

InChI

InChI=1S/C33H33Cl2FN2O4/c1-42-33(41)28-27(21-8-4-2-5-9-21)30(31(39)37-19-20-12-15-24(36)16-13-20)38(32(40)22-10-6-3-7-11-22)29(28)23-14-17-25(34)26(35)18-23/h2,4-5,8-9,12-18,22,27-30H,3,6-7,10-11,19H2,1H3,(H,37,39)