2-[2-(hydroxymethyl)-5-oxidanyl-4-oxidanylidene-pyridin-1-yl]ethanesulfonic acid

Systemtic Name: 2-[2-(hydroxymethyl)-5-oxidanyl-4-oxidanylidene-pyridin-1-yl]ethanesulfonic acid Openeye Name: 2-[5-hydroxy-2-(hydroxymethyl)-4-oxo-1-pyridyl]ethanesulfonic acid CAS Name: 2-[5-hydroxy-2-(hydroxymethyl)-4-oxo-1-pyridinyl]ethanesulfonic acid IUPAC Name: 2-[5-hydroxy-2-(hydroxymethyl)-4-oxopyridin-1-yl]ethanesulfonic acid Traditional Name: 2-(5-hydroxy-4-keto-2-methylol-1-pyridyl)ethanesulfonic acid Formula: C8H11NO6S MolecularWeight: 249.24104

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N(C=C(C1=O)O)CCS(=O)(=O)O)CO

Isomeric SMILES

C1=C(N(C=C(C1=O)O)CCS(=O)(=O)O)CO

InChI

InChI=1S/C8H11NO6S/c10-5-6-3-7(11)8(12)4-9(6)1-2-16(13,14)15/h3-4,10,12H,1-2,5H2,(H,13,14,15)