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

Systemtic Name: 1-(4-chlorophenyl)-2-(3-methylimidazol-3-ium-1-yl)ethanone bromide Openeye Name: 1-(4-chlorophenyl)-2-(3-methylimidazol-3-ium-1-yl)ethanone bromide CAS Name: 1-(4-chlorophenyl)-2-(3-methyl-1-imidazol-3-iumyl)ethanone bromide IUPAC Name: 1-(4-chlorophenyl)-2-(3-methylimidazol-3-ium-1-yl)ethanone bromide Traditional Name: 1-(4-chlorophenyl)-2-(3-methylimidazol-3-ium-1-yl)ethanone bromide Formula: C12H12BrClN2O MolecularWeight: 315.59348

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)CC(=O)C2=CC=C(C=C2)Cl.[Br-]

Isomeric SMILES

C[N+]1=CN(C=C1)CC(=O)C2=CC=C(C=C2)Cl.[Br-]

InChI

InChI=1S/C12H12ClN2O.BrH/c1-14-6-7-15(9-14)8-12(16)10-2-4-11(13)5-3-10;/h2-7,9H,8H2,1H3;1H/q+1;/p-1