1-(4-bromophenyl)-2-(2,3-dimethylimidazol-3-ium-1-yl)ethanone bromide

Systemtic Name: 1-(4-bromophenyl)-2-(2,3-dimethylimidazol-3-ium-1-yl)ethanone bromide Openeye Name: 1-(4-bromophenyl)-2-(2,3-dimethylimidazol-3-ium-1-yl)ethanone bromide CAS Name: 1-(4-bromophenyl)-2-(2,3-dimethyl-1-imidazol-3-iumyl)ethanone bromide IUPAC Name: 1-(4-bromophenyl)-2-(2,3-dimethylimidazol-3-ium-1-yl)ethanone bromide Traditional Name: 1-(4-bromophenyl)-2-(2,3-dimethylimidazol-3-ium-1-yl)ethanone bromide Formula: C13H14Br2N2O MolecularWeight: 374.07106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CN1CC(=O)C2=CC=C(C=C2)Br)C.[Br-]

Isomeric SMILES

CC1=[N+](C=CN1CC(=O)C2=CC=C(C=C2)Br)C.[Br-]

InChI

InChI=1S/C13H14BrN2O.BrH/c1-10-15(2)7-8-16(10)9-13(17)11-3-5-12(14)6-4-11;/h3-8H,9H2,1-2H3;1H/q+1;/p-1