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

Systemtic Name: 1-(4-methylphenyl)-2-(4-methylphthalazin-2-ium-2-yl)ethanone bromide Openeye Name: 2-(4-methylphthalazin-2-ium-2-yl)-1-(p-tolyl)ethanone bromide CAS Name: 1-(4-methylphenyl)-2-(4-methyl-2-phthalazin-2-iumyl)ethanone bromide IUPAC Name: 1-(4-methylphenyl)-2-(4-methylphthalazin-2-ium-2-yl)ethanone bromide Traditional Name: 2-(4-methylphthalazin-2-ium-2-yl)-1-(p-tolyl)ethanone bromide Formula: C18H17BrN2O MolecularWeight: 357.24438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C[N+]2=CC3=CC=CC=C3C(=N2)C.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C[N+]2=CC3=CC=CC=C3C(=N2)C.[Br-]

InChI

InChI=1S/C18H17N2O.BrH/c1-13-7-9-15(10-8-13)18(21)12-20-11-16-5-3-4-6-17(16)14(2)19-20;/h3-11H,12H2,1-2H3;1H/q+1;/p-1