2-methyl-4-[naphthalen-1-yl(pyridin-1-ium-1-yl)methyl]-1,2,4-triazol-4-ium-3-amine

Systemtic Name: 2-methyl-4-[naphthalen-1-yl(pyridin-1-ium-1-yl)methyl]-1,2,4-triazol-4-ium-3-amine Openeye Name: 2-methyl-4-[1-naphthyl(pyridin-1-ium-1-yl)methyl]-1,2,4-triazol-4-ium-3-amine CAS Name: 2-methyl-4-[1-naphthalenyl(1-pyridin-1-iumyl)methyl]-1,2,4-triazol-4-ium-3-amine IUPAC Name: 2-methyl-4-[naphthalen-1-yl(pyridin-1-ium-1-yl)methyl]-1,2,4-triazol-4-ium-3-amine Traditional Name: [2-methyl-4-[1-naphthyl(pyridin-1-ium-1-yl)methyl]-1,2,4-triazol-4-ium-3-yl]amine Formula: C19H19N5+2 MolecularWeight: 317.38766

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=[N+](C=N1)C(C2=CC=CC3=CC=CC=C32)[N+]4=CC=CC=C4)N

Isomeric SMILES

CN1C(=[N+](C=N1)C(C2=CC=CC3=CC=CC=C32)[N+]4=CC=CC=C4)N

InChI

InChI=1S/C19H18N5/c1-22-19(20)24(14-21-22)18(23-12-5-2-6-13-23)17-11-7-9-15-8-3-4-10-16(15)17/h2-14,18,20H,1H3/q+1/p+1