2-(2-azanyl-3-ethyl-benzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanone bromide

Systemtic Name: 2-(2-azanyl-3-ethyl-benzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanone bromide Openeye Name: 2-(2-amino-3-ethyl-benzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanone bromide CAS Name: 2-(2-amino-3-ethyl-1-benzimidazol-1-iumyl)-1-(4-chlorophenyl)ethanone bromide IUPAC Name: 2-(2-amino-3-ethylbenzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanone bromide Traditional Name: 2-(2-amino-3-ethyl-benzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanone bromide Formula: C17H17BrClN3O MolecularWeight: 394.69338

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C3=CC=C(C=C3)Cl.[Br-]

Isomeric SMILES

CCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C3=CC=C(C=C3)Cl.[Br-]

InChI

InChI=1S/C17H16ClN3O.BrH/c1-2-20-14-5-3-4-6-15(14)21(17(20)19)11-16(22)12-7-9-13(18)10-8-12;/h3-10,19H,2,11H2,1H3;1H