3-Ethyl 1,2-dihydro-2-oxo-5-sulfo-3-pyridinecarboxylate

CAS Registry Number®

334708-06-4
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CAS Name

3-Ethyl 1,2-dihydro-2-oxo-5-sulfo-3-pyridinecarboxylate

Molecular Formula

C8H9NO6S

Molecular Mass

247.23

Cite this Page

3-Ethyl 1,2-dihydro-2-oxo-5-sulfo-3-pyridinecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=334708-06-4 (retrieved 2024-05-02) (CAS RN: 334708-06-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H9NO6S/c1-2-15-8(11)6-3-5(16(12,13)14)4-9-7(6)10/h3-4H,2H2,1H3,(H,9,10)(H,12,13,14)

InChIKey

InChIKey=BXIIVRFUQABYFR-UHFFFAOYSA-N

SMILES

C(OCC)(=O)C1=CC(S(=O)(=O)O)=CNC1=O

Canonical SMILES

O=C(OCC)C1=CC(=CNC1=O)S(=O)(=O)O

Other Names for this Substance

  • 3-Pyridinecarboxylic acid, 1,2-dihydro-2-oxo-5-sulfo-, 3-ethyl ester
  • 3-Ethyl 1,2-dihydro-2-oxo-5-sulfo-3-pyridinecarboxylate
  • Ethyl 2-hydroxy-5-sulfonicotinate

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