4,5-bis(hydroxymethyl)-2-methyl-1-oxidanidyl-pyridin-1-ium-3-ol hydrochloride

Systemtic Name: 4,5-bis(hydroxymethyl)-2-methyl-1-oxidanidyl-pyridin-1-ium-3-ol hydrochloride Openeye Name: 4,5-bis(hydroxymethyl)-2-methyl-1-oxido-pyridin-1-ium-3-ol hydrochloride CAS Name: 4,5-bis(hydroxymethyl)-2-methyl-1-oxido-3-pyridin-1-iumol hydrochloride IUPAC Name: 4,5-bis(hydroxymethyl)-2-methyl-1-oxidopyridin-1-ium-3-ol hydrochloride Traditional Name: 2-methyl-4,5-dimethylol-1-oxido-pyridin-1-ium-3-ol hydrochloride Formula: C8H12ClNO4 MolecularWeight: 221.63818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H11NO4.ClH/c1-5-8(12)7(4-11)6(3-10)2-9(5)13;/h2,10-12H,3-4H2,1H3;1H