2-oxidanylidene-6-(piperidin-1-ium-1-ylmethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyridine-3-carboxamide

Systemtic Name: 2-oxidanylidene-6-(piperidin-1-ium-1-ylmethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyridine-3-carboxamide Openeye Name: 2-oxo-6-(piperidin-1-ium-1-ylmethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyridine-3-carboxamide CAS Name: 2-oxo-6-(1-piperidin-1-iumylmethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyridine-3-carboxamide IUPAC Name: 2-oxo-6-(piperidin-1-ium-1-ylmethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyridine-3-carboxamide Traditional Name: 2-keto-6-(piperidin-1-ium-1-ylmethyl)-N-[3-(trifluoromethyl)benzyl]-1H-pyridine-3-carboxamide Formula: C20H23F3N3O2+ MolecularWeight: 394.41073

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C(=O)N2)C(=O)NCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C(=O)N2)C(=O)NCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H22F3N3O2/c21-20(22,23)15-6-4-5-14(11-15)12-24-18(27)17-8-7-16(25-19(17)28)13-26-9-2-1-3-10-26/h4-8,11H,1-3,9-10,12-13H2,(H,24,27)(H,25,28)/p+1