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

Systemtic Name: 1-(2,4-dimethylphenyl)-2-(3-methylimidazol-3-ium-1-yl)ethanone bromide Openeye Name: 1-(2,4-dimethylphenyl)-2-(3-methylimidazol-3-ium-1-yl)ethanone bromide CAS Name: 1-(2,4-dimethylphenyl)-2-(3-methyl-1-imidazol-3-iumyl)ethanone bromide IUPAC Name: 1-(2,4-dimethylphenyl)-2-(3-methylimidazol-3-ium-1-yl)ethanone bromide Traditional Name: 1-(2,4-dimethylphenyl)-2-(3-methylimidazol-3-ium-1-yl)ethanone bromide Formula: C14H17BrN2O MolecularWeight: 309.20158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)CN2C=C[N+](=C2)C)C.[Br-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)CN2C=C[N+](=C2)C)C.[Br-]

InChI

InChI=1S/C14H17N2O.BrH/c1-11-4-5-13(12(2)8-11)14(17)9-16-7-6-15(3)10-16;/h4-8,10H,9H2,1-3H3;1H/q+1;/p-1