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

Systemtic Name: 2-[3-(4-chlorophenyl)pyridazin-1-ium-1-yl]-1-phenyl-ethanone bromide Openeye Name: 2-[3-(4-chlorophenyl)pyridazin-1-ium-1-yl]-1-phenyl-ethanone bromide CAS Name: 2-[3-(4-chlorophenyl)-1-pyridazin-1-iumyl]-1-phenylethanone bromide IUPAC Name: 2-[3-(4-chlorophenyl)pyridazin-1-ium-1-yl]-1-phenylethanone bromide Traditional Name: 2-[3-(4-chlorophenyl)pyridazin-1-ium-1-yl]-1-phenyl-ethanone bromide Formula: C18H14BrClN2O MolecularWeight: 389.67356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14ClN2O.BrH/c19-16-10-8-14(9-11-16)17-7-4-12-21(20-17)13-18(22)15-5-2-1-3-6-15;/h1-12H,13H2;1H/q+1;/p-1