3,5-bis(1H-imidazol-3-ium-3-ylmethyl)-1H-1,2,4-triazole

Systemtic Name: 3,5-bis(1H-imidazol-3-ium-3-ylmethyl)-1H-1,2,4-triazole Openeye Name: 3,5-bis(1H-imidazol-3-ium-3-ylmethyl)-1H-1,2,4-triazole CAS Name: 3,5-bis(1H-imidazol-3-ium-3-ylmethyl)-1H-1,2,4-triazole IUPAC Name: 3,5-bis(1H-imidazol-3-ium-3-ylmethyl)-1H-1,2,4-triazole Traditional Name: 3,5-bis(1H-imidazol-3-ium-3-ylmethyl)-1H-1,2,4-triazole Formula: C10H13N7+2 MolecularWeight: 231.25712

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[N+](=CN1)CC2=NC(=NN2)C[N+]3=CNC=C3

Isomeric SMILES

C1=C[N+](=CN1)CC2=NC(=NN2)C[N+]3=CNC=C3

InChI

InChI=1S/C10H11N7/c1-3-16(7-11-1)5-9-13-10(15-14-9)6-17-4-2-12-8-17/h1-4,7-8H,5-6H2,(H,13,14,15)/p+2