5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-1-ium-4-carbaldehyde chloride

Systemtic Name: 5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-1-ium-4-carbaldehyde chloride Openeye Name: 3-hydroxy-5-(hydroxymethyl)-2-methyl-pyridin-1-ium-4-carbaldehyde chloride CAS Name: 3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridin-1-iumcarboxaldehyde chloride IUPAC Name: 3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-1-ium-4-carbaldehyde chloride Traditional Name: 3-hydroxy-2-methyl-5-methylol-pyridin-1-ium-4-carbaldehyde chloride Formula: C8H10ClNO3 MolecularWeight: 203.6229

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C=C(C(=C1O)C=O)CO.[Cl-]

Isomeric SMILES

CC1=[NH+]C=C(C(=C1O)C=O)CO.[Cl-]

InChI

InChI=1S/C8H9NO3.ClH/c1-5-8(12)7(4-11)6(3-10)2-9-5;/h2,4,10,12H,3H2,1H3;1H