1-[3,4-bis(oxidanyl)phenyl]-2-[3-(4-bromophenyl)pyridazin-1-ium-1-yl]ethanone

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-[3-(4-bromophenyl)pyridazin-1-ium-1-yl]ethanone Openeye Name: 2-[3-(4-bromophenyl)pyridazin-1-ium-1-yl]-1-(3,4-dihydroxyphenyl)ethanone CAS Name: 2-[3-(4-bromophenyl)-1-pyridazin-1-iumyl]-1-(3,4-dihydroxyphenyl)ethanone IUPAC Name: 2-[3-(4-bromophenyl)pyridazin-1-ium-1-yl]-1-(3,4-dihydroxyphenyl)ethanone Traditional Name: 2-[3-(4-bromophenyl)pyridazin-1-ium-1-yl]-1-(3,4-dihydroxyphenyl)ethanone Formula: C18H14BrN2O3+ MolecularWeight: 386.21936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13BrN2O3/c19-14-6-3-12(4-7-14)15-2-1-9-21(20-15)11-18(24)13-5-8-16(22)17(23)10-13/h1-10,20H,11H2/p+1