1-[1-(2,6-dimethoxyphenyl)-5,6-di(imidazol-1-yl)benzimidazol-1-ium-1-yl]-N-methyl-methanamine

Systemtic Name: 1-[1-(2,6-dimethoxyphenyl)-5,6-di(imidazol-1-yl)benzimidazol-1-ium-1-yl]-N-methyl-methanamine Openeye Name: 1-[1-(2,6-dimethoxyphenyl)-5,6-di(imidazol-1-yl)benzimidazol-1-ium-1-yl]-N-methyl-methanamine CAS Name: 1-[1-(2,6-dimethoxyphenyl)-5,6-bis(1-imidazolyl)-1-benzimidazol-1-iumyl]-N-methylmethanamine IUPAC Name: 1-[1-(2,6-dimethoxyphenyl)-5,6-di(imidazol-1-yl)benzimidazol-1-ium-1-yl]-N-methylmethanamine Traditional Name: [1-(2,6-dimethoxyphenyl)-5,6-di(imidazol-1-yl)benzimidazol-1-ium-1-yl]methyl-methyl-amine Formula: C23H24N7O2+ MolecularWeight: 430.48236

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Descriptors Computed from Structure

Canonical SMILES:

CNC[N+]1(C=NC2=CC(=C(C=C21)N3C=CN=C3)N4C=CN=C4)C5=C(C=CC=C5OC)OC

Isomeric SMILES

CNC[N+]1(C=NC2=CC(=C(C=C21)N3C=CN=C3)N4C=CN=C4)C5=C(C=CC=C5OC)OC

InChI

InChI=1S/C23H24N7O2/c1-24-15-30(23-21(31-2)5-4-6-22(23)32-3)16-27-17-11-18(28-9-7-25-13-28)19(12-20(17)30)29-10-8-26-14-29/h4-14,16,24H,15H2,1-3H3/q+1