3,4-dimethylpyridin-1-ium-2,6-diol hydrobromide

Systemtic Name: 3,4-dimethylpyridin-1-ium-2,6-diol hydrobromide Openeye Name: 3,4-dimethylpyridin-1-ium-2,6-diol hydrobromide CAS Name: 3,4-dimethylpyridin-1-ium-2,6-diol hydrobromide IUPAC Name: 3,4-dimethylpyridin-1-ium-2,6-diol hydrobromide Traditional Name: 3,4-dimethylpyridin-1-ium-2,6-diol hydrobromide Formula: C7H11BrNO2+ MolecularWeight: 221.07174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=C1C)O)O.Br

Isomeric SMILES

CC1=CC(=[NH+]C(=C1C)O)O.Br

InChI

InChI=1S/C7H9NO2.BrH/c1-4-3-6(9)8-7(10)5(4)2;/h3H,1-2H3,(H2,8,9,10);1H/p+1