4,5-bis(hydroxymethyl)-1,2-dimethyl-pyridin-1-ium-3-ol iodide

Systemtic Name: 4,5-bis(hydroxymethyl)-1,2-dimethyl-pyridin-1-ium-3-ol iodide Openeye Name: 4,5-bis(hydroxymethyl)-1,2-dimethyl-pyridin-1-ium-3-ol iodide CAS Name: 4,5-bis(hydroxymethyl)-1,2-dimethyl-3-pyridin-1-iumol iodide IUPAC Name: 4,5-bis(hydroxymethyl)-1,2-dimethylpyridin-1-ium-3-ol iodide Traditional Name: 1,2-dimethyl-4,5-dimethylol-pyridin-1-ium-3-ol iodide Formula: C9H14INO3 MolecularWeight: 311.11683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C(=C1O)CO)CO)C.[I-]

Isomeric SMILES

CC1=[N+](C=C(C(=C1O)CO)CO)C.[I-]

InChI

InChI=1S/C9H13NO3.HI/c1-6-9(13)8(5-12)7(4-11)3-10(6)2;/h3,11-12H,4-5H2,1-2H3;1H