1-(4-chlorophenyl)-2-(3-methylbenzimidazol-3-ium-1-yl)ethanone bromide

Systemtic Name: 1-(4-chlorophenyl)-2-(3-methylbenzimidazol-3-ium-1-yl)ethanone bromide Openeye Name: 1-(4-chlorophenyl)-2-(3-methylbenzimidazol-3-ium-1-yl)ethanone bromide CAS Name: 1-(4-chlorophenyl)-2-(3-methyl-1-benzimidazol-3-iumyl)ethanone bromide IUPAC Name: 1-(4-chlorophenyl)-2-(3-methylbenzimidazol-3-ium-1-yl)ethanone bromide Traditional Name: 1-(4-chlorophenyl)-2-(3-methylbenzimidazol-3-ium-1-yl)ethanone bromide Formula: C16H14BrClN2O MolecularWeight: 365.65216

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C2=CC=CC=C21)CC(=O)C3=CC=C(C=C3)Cl.[Br-]

Isomeric SMILES

C[N+]1=CN(C2=CC=CC=C21)CC(=O)C3=CC=C(C=C3)Cl.[Br-]

InChI

InChI=1S/C16H14ClN2O.BrH/c1-18-11-19(15-5-3-2-4-14(15)18)10-16(20)12-6-8-13(17)9-7-12;/h2-9,11H,10H2,1H3;1H/q+1;/p-1