(phenylmethyl) 2-pyrrolidin-2-ylcarbonyl-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-pyrrolidin-2-ylcarbonyl-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxylate Openeye Name: benzyl 2-(pyrrolidine-2-carbonyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxylate CAS Name: 2-[oxo(2-pyrrolidinyl)methyl]-4-[3-(trifluoromethyl)phenyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(pyrrolidine-2-carbonyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxylate Traditional Name: 2-prolyl-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxylic acid benzyl ester Formula: C24H26F3N3O3 MolecularWeight: 461.47675

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)C2CN(CCN2C(=O)OCC3=CC=CC=C3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CC(NC1)C(=O)C2CN(CCN2C(=O)OCC3=CC=CC=C3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C24H26F3N3O3/c25-24(26,27)18-8-4-9-19(14-18)29-12-13-30(21(15-29)22(31)20-10-5-11-28-20)23(32)33-16-17-6-2-1-3-7-17/h1-4,6-9,14,20-21,28H,5,10-13,15-16H2