1-(4-bromophenyl)-2-(1,3-dimethylbenzimidazol-3-ium-2-yl)ethanone chloride

Systemtic Name: 1-(4-bromophenyl)-2-(1,3-dimethylbenzimidazol-3-ium-2-yl)ethanone chloride Openeye Name: 1-(4-bromophenyl)-2-(1,3-dimethylbenzimidazol-3-ium-2-yl)ethanone chloride CAS Name: 1-(4-bromophenyl)-2-(1,3-dimethyl-2-benzimidazol-3-iumyl)ethanone chloride IUPAC Name: 1-(4-bromophenyl)-2-(1,3-dimethylbenzimidazol-3-ium-2-yl)ethanone chloride Traditional Name: 1-(4-bromophenyl)-2-(1,3-dimethylbenzimidazol-3-ium-2-yl)ethanone chloride Formula: C17H16BrClN2O MolecularWeight: 379.67874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2[N+](=C1CC(=O)C3=CC=C(C=C3)Br)C.[Cl-]

Isomeric SMILES

CN1C2=CC=CC=C2[N+](=C1CC(=O)C3=CC=C(C=C3)Br)C.[Cl-]

InChI

InChI=1S/C17H16BrN2O.ClH/c1-19-14-5-3-4-6-15(14)20(2)17(19)11-16(21)12-7-9-13(18)10-8-12;/h3-10H,11H2,1-2H3;1H/q+1;/p-1