2-[3-(4-chlorophenyl)pyridazin-1-ium-1-yl]-1-(4-methoxyphenyl)ethanone bromide

Systemtic Name: 2-[3-(4-chlorophenyl)pyridazin-1-ium-1-yl]-1-(4-methoxyphenyl)ethanone bromide Openeye Name: 2-[3-(4-chlorophenyl)pyridazin-1-ium-1-yl]-1-(4-methoxyphenyl)ethanone bromide CAS Name: 2-[3-(4-chlorophenyl)-1-pyridazin-1-iumyl]-1-(4-methoxyphenyl)ethanone bromide IUPAC Name: 2-[3-(4-chlorophenyl)pyridazin-1-ium-1-yl]-1-(4-methoxyphenyl)ethanone bromide Traditional Name: 2-[3-(4-chlorophenyl)pyridazin-1-ium-1-yl]-1-(4-methoxyphenyl)ethanone bromide Formula: C19H16BrClN2O2 MolecularWeight: 419.69954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C[N+]2=CC=CC(=N2)C3=CC=C(C=C3)Cl.[Br-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C[N+]2=CC=CC(=N2)C3=CC=C(C=C3)Cl.[Br-]

InChI

InChI=1S/C19H16ClN2O2.BrH/c1-24-17-10-6-15(7-11-17)19(23)13-22-12-2-3-18(21-22)14-4-8-16(20)9-5-14;/h2-12H,13H2,1H3;1H/q+1;/p-1