1-(4-methylphenyl)-2-(4-methylpyridin-1-ium-1-yl)ethanone bromide

Systemtic Name: 1-(4-methylphenyl)-2-(4-methylpyridin-1-ium-1-yl)ethanone bromide Openeye Name: 2-(4-methylpyridin-1-ium-1-yl)-1-(p-tolyl)ethanone bromide CAS Name: 1-(4-methylphenyl)-2-(4-methyl-1-pyridin-1-iumyl)ethanone bromide IUPAC Name: 1-(4-methylphenyl)-2-(4-methylpyridin-1-ium-1-yl)ethanone bromide Traditional Name: 2-(4-methylpyridin-1-ium-1-yl)-1-(p-tolyl)ethanone bromide Formula: C15H16BrNO MolecularWeight: 306.19764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)C.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)C.[Br-]

InChI

InChI=1S/C15H16NO.BrH/c1-12-3-5-14(6-4-12)15(17)11-16-9-7-13(2)8-10-16;/h3-10H,11H2,1-2H3;1H/q+1;/p-1