4-[(5-azanyl-1-methyl-1,2,4-triazol-4-ium-4-yl)-(4-methylphenyl)methyl]-2-methyl-1,2,4-triazol-4-ium-3-amine

Systemtic Name: 4-[(5-azanyl-1-methyl-1,2,4-triazol-4-ium-4-yl)-(4-methylphenyl)methyl]-2-methyl-1,2,4-triazol-4-ium-3-amine Openeye Name: 4-[(5-amino-1-methyl-1,2,4-triazol-4-ium-4-yl)-(p-tolyl)methyl]-2-methyl-1,2,4-triazol-4-ium-3-amine CAS Name: 4-[(5-amino-1-methyl-1,2,4-triazol-4-ium-4-yl)-(4-methylphenyl)methyl]-2-methyl-1,2,4-triazol-4-ium-3-amine IUPAC Name: 4-[(5-amino-1-methyl-1,2,4-triazol-4-ium-4-yl)-(4-methylphenyl)methyl]-2-methyl-1,2,4-triazol-4-ium-3-amine Traditional Name: [4-[(5-amino-1-methyl-1,2,4-triazol-4-ium-4-yl)-(p-tolyl)methyl]-2-methyl-1,2,4-triazol-4-ium-3-yl]amine Formula: C14H20N8+2 MolecularWeight: 300.3622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C([N+]2=C(N(N=C2)C)N)[N+]3=C(N(N=C3)C)N

Isomeric SMILES

CC1=CC=C(C=C1)C([N+]2=C(N(N=C2)C)N)[N+]3=C(N(N=C3)C)N

InChI

InChI=1S/C14H18N8/c1-10-4-6-11(7-5-10)12(21-8-17-19(2)13(21)15)22-9-18-20(3)14(22)16/h4-9,12,15-16H,1-3H3/p+2