1-methylpyridin-1-ium-3-ol ethanoate hydroiodide

Systemtic Name: 1-methylpyridin-1-ium-3-ol ethanoate hydroiodide Openeye Name: 1-methylpyridin-1-ium-3-ol acetate hydroiodide CAS Name: 1-methyl-3-pyridin-1-iumol acetate hydroiodide IUPAC Name: 1-methylpyridin-1-ium-3-ol acetate hydroiodide Traditional Name: 1-methylpyridin-1-ium-3-ol acetate hydroiodide Formula: C8H12INO3 MolecularWeight: 297.09025

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H7NO.C2H4O2.HI/c1-7-4-2-3-6(8)5-7;1-2(3)4;/h2-5H,1H3;1H3,(H,3,4);1H