N-(2-methylphenyl)-1-pyridin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-amine

Systemtic Name: N-(2-methylphenyl)-1-pyridin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-amine Openeye Name: N-(o-tolyl)-1-(2-pyridyl)-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-amine CAS Name: N-(2-methylphenyl)-1-(2-pyridinyl)-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-amine IUPAC Name: N-(2-methylphenyl)-1-pyridin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-amine Traditional Name: o-tolyl-[1-(2-pyridyl)-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-yl]amine Formula: C18H16N5+ MolecularWeight: 302.35314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NN(C3=CC=CC=[N+]32)C4=CC=CC=N4

Isomeric SMILES

CC1=CC=CC=C1NC2=NN(C3=CC=CC=[N+]32)C4=CC=CC=N4

InChI

InChI=1S/C18H16N5/c1-14-8-2-3-9-15(14)20-18-21-23(16-10-4-6-12-19-16)17-11-5-7-13-22(17)18/h2-13H,1H3,(H,20,21)/q+1