4-[4-(Methylsulfonyl)phenyl]-3-pyridinecarboxylic acid

CAS Registry Number®

1261971-95-2

CAS Name

4-[4-(Methylsulfonyl)phenyl]-3-pyridinecarboxylic acid

Molecular Formula

C13H11NO4S

Molecular Mass

277.30

Cite this Page

4-[4-(Methylsulfonyl)phenyl]-3-pyridinecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1261971-95-2 (retrieved 2024-11-23) (CAS RN: 1261971-95-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H11NO4S/c1-19(17,18)10-4-2-9(3-5-10)11-6-7-14-8-12(11)13(15)16/h2-8H,1H3,(H,15,16)

InChIKey

InChIKey=ODAZUHBVZAVTHV-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1C(=CC=NC1)C2=CC=C(S(C)(=O)=O)C=C2

Canonical SMILES

O=C(O)C=1C=NC=CC1C=2C=CC(=CC2)S(=O)(=O)C

Other Names for this Substance

  • 3-Pyridinecarboxylic acid, 4-[4-(methylsulfonyl)phenyl]-
  • 4-[4-(Methylsulfonyl)phenyl]-3-pyridinecarboxylic acid

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