2-methyl-4-(1-pyridin-1-ium-1-ylpropyl)-1,2,4-triazol-4-ium-3-amine

Systemtic Name: 2-methyl-4-(1-pyridin-1-ium-1-ylpropyl)-1,2,4-triazol-4-ium-3-amine Openeye Name: 2-methyl-4-(1-pyridin-1-ium-1-ylpropyl)-1,2,4-triazol-4-ium-3-amine CAS Name: 2-methyl-4-[1-(1-pyridin-1-iumyl)propyl]-1,2,4-triazol-4-ium-3-amine IUPAC Name: 2-methyl-4-(1-pyridin-1-ium-1-ylpropyl)-1,2,4-triazol-4-ium-3-amine Traditional Name: [2-methyl-4-(1-pyridin-1-ium-1-ylpropyl)-1,2,4-triazol-4-ium-3-yl]amine Formula: C11H17N5+2 MolecularWeight: 219.28618

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Descriptors Computed from Structure

Canonical SMILES:

CCC([N+]1=CC=CC=C1)[N+]2=C(N(N=C2)C)N

Isomeric SMILES

CCC([N+]1=CC=CC=C1)[N+]2=C(N(N=C2)C)N

InChI

InChI=1S/C11H16N5/c1-3-10(15-7-5-4-6-8-15)16-9-13-14(2)11(16)12/h4-10,12H,3H2,1-2H3/q+1/p+1