6-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-N-[[3-(trifluoromethyloxy)phenyl]methyl]cyclohex-3-ene-1-carboxamide

Systemtic Name: 6-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-N-[[3-(trifluoromethyloxy)phenyl]methyl]cyclohex-3-ene-1-carboxamide Openeye Name: 6-[4-(2-pyridyl)piperazine-1-carbonyl]-N-[[3-(trifluoromethoxy)phenyl]methyl]cyclohex-3-ene-1-carboxamide CAS Name: 6-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-N-[[3-(trifluoromethoxy)phenyl]methyl]-1-cyclohex-3-enecarboxamide IUPAC Name: 6-(4-pyridin-2-ylpiperazine-1-carbonyl)-N-[[3-(trifluoromethoxy)phenyl]methyl]cyclohex-3-ene-1-carboxamide Traditional Name: 6-[4-(2-pyridyl)piperazine-1-carbonyl]-N-[3-(trifluoromethoxy)benzyl]cyclohex-3-ene-1-carboxamide Formula: C25H27F3N4O3 MolecularWeight: 488.50209

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)C3CC=CCC3C(=O)NCC4=CC(=CC=C4)OC(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)C3CC=CCC3C(=O)NCC4=CC(=CC=C4)OC(F)(F)F

InChI

InChI=1S/C25H27F3N4O3/c26-25(27,28)35-19-7-5-6-18(16-19)17-30-23(33)20-8-1-2-9-21(20)24(34)32-14-12-31(13-15-32)22-10-3-4-11-29-22/h1-7,10-11,16,20-21H,8-9,12-15,17H2,(H,30,33)