2-methyl-7-[pyridin-1-ium-3-yl-[[3-(trifluoromethyl)phenyl]amino]methyl]quinolin-1-ium-8-ol

Systemtic Name: 2-methyl-7-[pyridin-1-ium-3-yl-[[3-(trifluoromethyl)phenyl]amino]methyl]quinolin-1-ium-8-ol Openeye Name: 2-methyl-7-[pyridin-1-ium-3-yl-[3-(trifluoromethyl)anilino]methyl]quinolin-1-ium-8-ol CAS Name: 2-methyl-7-[3-pyridin-1-iumyl-[3-(trifluoromethyl)anilino]methyl]-8-quinolin-1-iumol IUPAC Name: 2-methyl-7-[pyridin-1-ium-3-yl-[3-(trifluoromethyl)anilino]methyl]quinolin-1-ium-8-ol Traditional Name: 2-methyl-7-[pyridin-1-ium-3-yl-[3-(trifluoromethyl)anilino]methyl]quinolin-1-ium-8-ol Formula: C23H20F3N3O+2 MolecularWeight: 411.41961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C2=C(C=C1)C=CC(=C2O)C(C3=C[NH+]=CC=C3)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CC1=[NH+]C2=C(C=C1)C=CC(=C2O)C(C3=C[NH+]=CC=C3)NC4=CC=CC(=C4)C(F)(F)F

InChI

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