ethyl 1-cyclopropylcarbonyl-2-(3,4-dichlorophenyl)-5-[(4-fluorophenyl)methylcarbamoyl]pyrrolidine-3-carboxylate

Systemtic Name: ethyl 1-cyclopropylcarbonyl-2-(3,4-dichlorophenyl)-5-[(4-fluorophenyl)methylcarbamoyl]pyrrolidine-3-carboxylate Openeye Name: ethyl 1-(cyclopropanecarbonyl)-2-(3,4-dichlorophenyl)-5-[(4-fluorophenyl)methylcarbamoyl]pyrrolidine-3-carboxylate CAS Name: 1-[cyclopropyl(oxo)methyl]-2-(3,4-dichlorophenyl)-5-[[(4-fluorophenyl)methylamino]-oxomethyl]-3-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(cyclopropanecarbonyl)-2-(3,4-dichlorophenyl)-5-[(4-fluorophenyl)methylcarbamoyl]pyrrolidine-3-carboxylate Traditional Name: 1-(cyclopropanecarbonyl)-2-(3,4-dichlorophenyl)-5-[(4-fluorobenzyl)carbamoyl]pyrrolidine-3-carboxylic acid ethyl ester Formula: C25H25Cl2FN2O4 MolecularWeight: 507.381403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(N(C1C2=CC(=C(C=C2)Cl)Cl)C(=O)C3CC3)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1CC(N(C1C2=CC(=C(C=C2)Cl)Cl)C(=O)C3CC3)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C25H25Cl2FN2O4/c1-2-34-25(33)18-12-21(23(31)29-13-14-3-8-17(28)9-4-14)30(24(32)15-5-6-15)22(18)16-7-10-19(26)20(27)11-16/h3-4,7-11,15,18,21-22H,2,5-6,12-13H2,1H3,(H,29,31)