1-[1-(2,6-dimethoxyphenyl)-6-(4-fluorophenyl)-5-imidazol-1-yl-benzimidazol-1-ium-1-yl]-N-methyl-methanamine

Systemtic Name: 1-[1-(2,6-dimethoxyphenyl)-6-(4-fluorophenyl)-5-imidazol-1-yl-benzimidazol-1-ium-1-yl]-N-methyl-methanamine Openeye Name: 1-[1-(2,6-dimethoxyphenyl)-6-(4-fluorophenyl)-5-imidazol-1-yl-benzimidazol-1-ium-1-yl]-N-methyl-methanamine CAS Name: 1-[1-(2,6-dimethoxyphenyl)-6-(4-fluorophenyl)-5-(1-imidazolyl)-1-benzimidazol-1-iumyl]-N-methylmethanamine IUPAC Name: 1-[1-(2,6-dimethoxyphenyl)-6-(4-fluorophenyl)-5-imidazol-1-ylbenzimidazol-1-ium-1-yl]-N-methylmethanamine Traditional Name: [1-(2,6-dimethoxyphenyl)-6-(4-fluorophenyl)-5-imidazol-1-yl-benzimidazol-1-ium-1-yl]methyl-methyl-amine Formula: C26H25FN5O2+ MolecularWeight: 458.507403

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Descriptors Computed from Structure

Canonical SMILES:

CNC[N+]1(C=NC2=C1C=C(C(=C2)N3C=CN=C3)C4=CC=C(C=C4)F)C5=C(C=CC=C5OC)OC

Isomeric SMILES

CNC[N+]1(C=NC2=C1C=C(C(=C2)N3C=CN=C3)C4=CC=C(C=C4)F)C5=C(C=CC=C5OC)OC

InChI

InChI=1S/C26H25FN5O2/c1-28-16-32(26-24(33-2)5-4-6-25(26)34-3)17-30-21-14-22(31-12-11-29-15-31)20(13-23(21)32)18-7-9-19(27)10-8-18/h4-15,17,28H,16H2,1-3H3/q+1