1H-imidazol-2-ylmethyl-[[2-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]methyl]azanium

Systemtic Name: 1H-imidazol-2-ylmethyl-[[2-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]methyl]azanium Openeye Name: 1H-imidazol-2-ylmethyl-[[2-[3-(trifluoromethyl)phenoxy]-3-pyridyl]methyl]ammonium CAS Name: 1H-imidazol-2-ylmethyl-[[2-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methyl]ammonium IUPAC Name: 1H-imidazol-2-ylmethyl-[[2-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]methyl]azanium Traditional Name: 1H-imidazol-2-ylmethyl-[[2-[3-(trifluoromethyl)phenoxy]-3-pyridyl]methyl]ammonium Formula: C17H16F3N4O+ MolecularWeight: 349.33035

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=C(C=CC=N2)C[NH2+]CC3=NC=CN3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)OC2=C(C=CC=N2)C[NH2+]CC3=NC=CN3)C(F)(F)F

InChI

InChI=1S/C17H15F3N4O/c18-17(19,20)13-4-1-5-14(9-13)25-16-12(3-2-6-24-16)10-21-11-15-22-7-8-23-15/h1-9,21H,10-11H2,(H,22,23)/p+1