2-(1-hydroxyethyl)-1-(3-oxidanylpropyl)pyridin-1-ium-3,4-diol chloride

Systemtic Name: 2-(1-hydroxyethyl)-1-(3-oxidanylpropyl)pyridin-1-ium-3,4-diol chloride Openeye Name: 2-(1-hydroxyethyl)-1-(3-hydroxypropyl)pyridin-1-ium-3,4-diol chloride CAS Name: 2-(1-hydroxyethyl)-1-(3-hydroxypropyl)pyridin-1-ium-3,4-diol chloride IUPAC Name: 2-(1-hydroxyethyl)-1-(3-hydroxypropyl)pyridin-1-ium-3,4-diol chloride Traditional Name: 2-(1-hydroxyethyl)-1-(3-hydroxypropyl)pyridin-1-ium-3,4-diol chloride Formula: C10H16ClNO4 MolecularWeight: 249.69134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=[N+](C=CC(=C1O)O)CCCO)O.[Cl-]

Isomeric SMILES

CC(C1=[N+](C=CC(=C1O)O)CCCO)O.[Cl-]

InChI

InChI=1S/C10H15NO4.ClH/c1-7(13)9-10(15)8(14)3-5-11(9)4-2-6-12;/h3,5,7,12-13,15H,2,4,6H2,1H3;1H