5-(benzimidazol-2-ylidene)-3-(phenylmethyl)-1,2-dihydro-1,2,3-triazol-3-ium-4-amine

Systemtic Name: 5-(benzimidazol-2-ylidene)-3-(phenylmethyl)-1,2-dihydro-1,2,3-triazol-3-ium-4-amine Openeye Name: 5-(benzimidazol-2-ylidene)-3-benzyl-1,2-dihydrotriazol-3-ium-4-amine CAS Name: 5-(2-benzimidazolylidene)-3-(phenylmethyl)-1,2-dihydrotriazol-3-ium-4-amine IUPAC Name: 5-(benzimidazol-2-ylidene)-3-benzyl-1,2-dihydrotriazol-3-ium-4-amine Traditional Name: [5-(benzimidazol-2-ylidene)-3-benzyl-1,2-dihydrotriazol-3-ium-4-yl]amine Formula: C16H15N6+ MolecularWeight: 291.3305

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(C(=C3N=C4C=CC=CC4=N3)NN2)N

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(C(=C3N=C4C=CC=CC4=N3)NN2)N

InChI

InChI=1S/C16H14N6/c17-15-14(16-18-12-8-4-5-9-13(12)19-16)20-21-22(15)10-11-6-2-1-3-7-11/h1-9H,10H2,(H3,17,18,19,20,21)/p+1