2-[[(4-Cyanophenyl)methyl]sulfonyl]acetic acid

CAS Registry Number®

300700-05-4
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CAS Name

2-[[(4-Cyanophenyl)methyl]sulfonyl]acetic acid

Molecular Formula

C10H9NO4S

Molecular Mass

239.25

Cite this Page

2-[[(4-Cyanophenyl)methyl]sulfonyl]acetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=300700-05-4 (retrieved 2024-09-09) (CAS RN: 300700-05-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H9NO4S/c11-5-8-1-3-9(4-2-8)6-16(14,15)7-10(12)13/h1-4H,6-7H2,(H,12,13)

InChIKey

InChIKey=DGZLPEXTGJUEHL-UHFFFAOYSA-N

SMILES

C(S(CC(O)=O)(=O)=O)C1=CC=C(C#N)C=C1

Canonical SMILES

N#CC1=CC=C(C=C1)CS(=O)(=O)CC(=O)O

Other Names for this Substance

  • Acetic acid, 2-[[(4-cyanophenyl)methyl]sulfonyl]-
  • Acetic acid, [[(4-cyanophenyl)methyl]sulfonyl]-
  • 2-[[(4-Cyanophenyl)methyl]sulfonyl]acetic acid
  • 4-Cyanobenzylsulfonylacetic acid
  • 2-[(4-Cyanophenyl)methanesulfonyl]acetic acid