1-(4-bromophenyl)-2-[3-(phenylmethyl)benzimidazol-3-ium-1-yl]ethanone

Systemtic Name: 1-(4-bromophenyl)-2-[3-(phenylmethyl)benzimidazol-3-ium-1-yl]ethanone Openeye Name: 2-(3-benzylbenzimidazol-3-ium-1-yl)-1-(4-bromophenyl)ethanone CAS Name: 1-(4-bromophenyl)-2-[3-(phenylmethyl)-1-benzimidazol-3-iumyl]ethanone IUPAC Name: 2-(3-benzylbenzimidazol-3-ium-1-yl)-1-(4-bromophenyl)ethanone Traditional Name: 2-(3-benzylbenzimidazol-3-ium-1-yl)-1-(4-bromophenyl)ethanone Formula: C22H18BrN2O+ MolecularWeight: 406.29512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CN(C3=CC=CC=C32)CC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CN(C3=CC=CC=C32)CC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H18BrN2O/c23-19-12-10-18(11-13-19)22(26)15-25-16-24(14-17-6-2-1-3-7-17)20-8-4-5-9-21(20)25/h1-13,16H,14-15H2/q+1