2-[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]ethanesulfonic acid

Systemtic Name: 2-[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]ethanesulfonic acid Openeye Name: 2-[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridyl]ethanesulfonic acid CAS Name: 2-[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]ethanesulfonic acid IUPAC Name: 2-[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]ethanesulfonic acid Traditional Name: 2-(3-hydroxy-2-methyl-5-methylol-4-pyridyl)ethanesulfonic acid Formula: C9H13NO5S MolecularWeight: 247.26822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CCS(=O)(=O)O)CO

Isomeric SMILES

CC1=NC=C(C(=C1O)CCS(=O)(=O)O)CO

InChI

InChI=1S/C9H13NO5S/c1-6-9(12)8(2-3-16(13,14)15)7(5-11)4-10-6/h4,11-12H,2-3,5H2,1H3,(H,13,14,15)