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

Systemtic Name: 2-[3-(4-chlorophenyl)pyridazin-1-ium-1-yl]-1-(4-nitrophenyl)ethanone bromide Openeye Name: 2-[3-(4-chlorophenyl)pyridazin-1-ium-1-yl]-1-(4-nitrophenyl)ethanone bromide CAS Name: 2-[3-(4-chlorophenyl)-1-pyridazin-1-iumyl]-1-(4-nitrophenyl)ethanone bromide IUPAC Name: 2-[3-(4-chlorophenyl)pyridazin-1-ium-1-yl]-1-(4-nitrophenyl)ethanone bromide Traditional Name: 2-[3-(4-chlorophenyl)pyridazin-1-ium-1-yl]-1-(4-nitrophenyl)ethanone bromide Formula: C18H13BrClN3O3 MolecularWeight: 434.67112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=N[N+](=C1)CC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl.[Br-]

Isomeric SMILES

C1=CC(=N[N+](=C1)CC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl.[Br-]

InChI

InChI=1S/C18H13ClN3O3.BrH/c19-15-7-3-13(4-8-15)17-2-1-11-21(20-17)12-18(23)14-5-9-16(10-6-14)22(24)25;/h1-11H,12H2;1H/q+1;/p-1