4-[(4-cyanophenyl)methyl]-N-[[2-(trifluoromethyloxy)phenyl]methyl]piperazine-1-carboxamide

Systemtic Name: 4-[(4-cyanophenyl)methyl]-N-[[2-(trifluoromethyloxy)phenyl]methyl]piperazine-1-carboxamide Openeye Name: 4-[(4-cyanophenyl)methyl]-N-[[2-(trifluoromethoxy)phenyl]methyl]piperazine-1-carboxamide CAS Name: 4-[(4-cyanophenyl)methyl]-N-[[2-(trifluoromethoxy)phenyl]methyl]-1-piperazinecarboxamide IUPAC Name: 4-[(4-cyanophenyl)methyl]-N-[[2-(trifluoromethoxy)phenyl]methyl]piperazine-1-carboxamide Traditional Name: 4-(4-cyanobenzyl)-N-[2-(trifluoromethoxy)benzyl]piperazine-1-carboxamide Formula: C21H21F3N4O2 MolecularWeight: 418.41225

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)NCC3=CC=CC=C3OC(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)NCC3=CC=CC=C3OC(F)(F)F

InChI

InChI=1S/C21H21F3N4O2/c22-21(23,24)30-19-4-2-1-3-18(19)14-26-20(29)28-11-9-27(10-12-28)15-17-7-5-16(13-25)6-8-17/h1-8H,9-12,14-15H2,(H,26,29)