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

Systemtic Name: 1-(4-methoxyphenyl)-2-(4-methylphthalazin-2-ium-2-yl)ethanone bromide Openeye Name: 1-(4-methoxyphenyl)-2-(4-methylphthalazin-2-ium-2-yl)ethanone bromide CAS Name: 1-(4-methoxyphenyl)-2-(4-methyl-2-phthalazin-2-iumyl)ethanone bromide IUPAC Name: 1-(4-methoxyphenyl)-2-(4-methylphthalazin-2-ium-2-yl)ethanone bromide Traditional Name: 1-(4-methoxyphenyl)-2-(4-methylphthalazin-2-ium-2-yl)ethanone bromide Formula: C18H17BrN2O2 MolecularWeight: 373.24378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=N[N+](=CC2=CC=CC=C12)CC(=O)C3=CC=C(C=C3)OC.[Br-]

Isomeric SMILES

CC1=N[N+](=CC2=CC=CC=C12)CC(=O)C3=CC=C(C=C3)OC.[Br-]

InChI

InChI=1S/C18H17N2O2.BrH/c1-13-17-6-4-3-5-15(17)11-20(19-13)12-18(21)14-7-9-16(22-2)10-8-14;/h3-11H,12H2,1-2H3;1H/q+1;/p-1