(E)-bis(3-methyl-2-phenyl-benzimidazol-3-ium-1-yl)diazene dichloride

Systemtic Name: (E)-bis(3-methyl-2-phenyl-benzimidazol-3-ium-1-yl)diazene dichloride Openeye Name: (E)-bis(3-methyl-2-phenyl-benzimidazol-3-ium-1-yl)diazene dichloride CAS Name: (E)-bis(3-methyl-2-phenyl-1-benzimidazol-3-iumyl)diazene dichloride IUPAC Name: (E)-bis(3-methyl-2-phenylbenzimidazol-3-ium-1-yl)diazene dichloride Traditional Name: (E)-bis(3-methyl-2-phenyl-benzimidazol-3-ium-1-yl)diazene dichloride Formula: C28H24Cl2N6 MolecularWeight: 515.43636

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(N(C2=CC=CC=C21)N=NN3C4=CC=CC=C4[N+](=C3C5=CC=CC=C5)C)C6=CC=CC=C6.[Cl-].[Cl-]

Isomeric SMILES

C[N+]1=C(N(C2=CC=CC=C21)/N=N/N3C4=CC=CC=C4[N+](=C3C5=CC=CC=C5)C)C6=CC=CC=C6.[Cl-].[Cl-]

InChI

InChI=1S/C28H24N6.2ClH/c1-31-23-17-9-11-19-25(23)33(27(31)21-13-5-3-6-14-21)29-30-34-26-20-12-10-18-24(26)32(2)28(34)22-15-7-4-8-16-22;;/h3-20H,1-2H3;2*1H/q+2;;/p-2/b30-29+;;