2-[1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-4-yl]-1H-benzimidazole

Systemtic Name: 2-[1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-4-yl]-1H-benzimidazole Openeye Name: 2-[1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-4-yl]-1H-benzimidazole CAS Name: 2-[1-[[3-(trifluoromethyl)phenyl]methyl]-4-piperidin-1-iumyl]-1H-benzimidazole IUPAC Name: 2-[1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-4-yl]-1H-benzimidazole Traditional Name: 2-[1-[3-(trifluoromethyl)benzyl]piperidin-1-ium-4-yl]-1H-benzimidazole Formula: C20H21F3N3+ MolecularWeight: 360.39605

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=NC3=CC=CC=C3N2)CC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1C[NH+](CCC1C2=NC3=CC=CC=C3N2)CC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C20H20F3N3/c21-20(22,23)16-5-3-4-14(12-16)13-26-10-8-15(9-11-26)19-24-17-6-1-2-7-18(17)25-19/h1-7,12,15H,8-11,13H2,(H,24,25)/p+1