7-[[(6-methylpyridin-1-ium-2-yl)amino]-[4-(trifluoromethyl)phenyl]methyl]quinolin-1-ium-8-ol

Systemtic Name: 7-[[(6-methylpyridin-1-ium-2-yl)amino]-[4-(trifluoromethyl)phenyl]methyl]quinolin-1-ium-8-ol Openeye Name: 7-[[(6-methylpyridin-1-ium-2-yl)amino]-[4-(trifluoromethyl)phenyl]methyl]quinolin-1-ium-8-ol CAS Name: 7-[[(6-methyl-2-pyridin-1-iumyl)amino]-[4-(trifluoromethyl)phenyl]methyl]-8-quinolin-1-iumol IUPAC Name: 7-[[(6-methylpyridin-1-ium-2-yl)amino]-[4-(trifluoromethyl)phenyl]methyl]quinolin-1-ium-8-ol Traditional Name: 7-[[(6-methylpyridin-1-ium-2-yl)amino]-[4-(trifluoromethyl)phenyl]methyl]quinolin-1-ium-8-ol Formula: C23H20F3N3O+2 MolecularWeight: 411.41961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C(=CC=C1)NC(C2=CC=C(C=C2)C(F)(F)F)C3=C(C4=C(C=CC=[NH+]4)C=C3)O

Isomeric SMILES

CC1=[NH+]C(=CC=C1)NC(C2=CC=C(C=C2)C(F)(F)F)C3=C(C4=C(C=CC=[NH+]4)C=C3)O

InChI

InChI=1S/C23H18F3N3O/c1-14-4-2-6-19(28-14)29-20(16-7-10-17(11-8-16)23(24,25)26)18-12-9-15-5-3-13-27-21(15)22(18)30/h2-13,20,30H,1H3,(H,28,29)/p+2