4-(1-methylpyridin-1-ium-4-yl)benzene-1,2-diol bromide

Systemtic Name: 4-(1-methylpyridin-1-ium-4-yl)benzene-1,2-diol bromide Openeye Name: 4-(1-methylpyridin-1-ium-4-yl)benzene-1,2-diol bromide CAS Name: 4-(1-methyl-4-pyridin-1-iumyl)benzene-1,2-diol bromide IUPAC Name: 4-(1-methylpyridin-1-ium-4-yl)benzene-1,2-diol bromide Traditional Name: 4-(1-methylpyridin-1-ium-4-yl)pyrocatechol bromide Formula: C12H12BrNO2 MolecularWeight: 282.13318

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C2=CC(=C(C=C2)O)O.[Br-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)C2=CC(=C(C=C2)O)O.[Br-]

InChI

InChI=1S/C12H11NO2.BrH/c1-13-6-4-9(5-7-13)10-2-3-11(14)12(15)8-10;/h2-8,15H,1H3;1H