2-[4-(1H-benzimidazol-2-yl)phenyl]-1-methyl-3H-benzimidazol-1-ium-5-amine

Systemtic Name: 2-[4-(1H-benzimidazol-2-yl)phenyl]-1-methyl-3H-benzimidazol-1-ium-5-amine Openeye Name: 2-[4-(1H-benzimidazol-2-yl)phenyl]-1-methyl-3H-benzimidazol-1-ium-5-amine CAS Name: 2-[4-(1H-benzimidazol-2-yl)phenyl]-1-methyl-3H-benzimidazol-1-ium-5-amine IUPAC Name: 2-[4-(1H-benzimidazol-2-yl)phenyl]-1-methyl-3H-benzimidazol-1-ium-5-amine Traditional Name: [2-[4-(1H-benzimidazol-2-yl)phenyl]-1-methyl-3H-benzimidazol-1-ium-5-yl]amine Formula: C21H18N5+ MolecularWeight: 340.40112

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC2=C1C=CC(=C2)N)C3=CC=C(C=C3)C4=NC5=CC=CC=C5N4

Isomeric SMILES

C[N+]1=C(NC2=C1C=CC(=C2)N)C3=CC=C(C=C3)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C21H17N5/c1-26-19-11-10-15(22)12-18(19)25-21(26)14-8-6-13(7-9-14)20-23-16-4-2-3-5-17(16)24-20/h2-12H,22H2,1H3,(H,23,24,25)/p+1