3-[(2-Propyn-1-ylamino)sulfonyl]benzoic acid

CAS Registry Number®

868238-01-1

CAS Name

3-[(2-Propyn-1-ylamino)sulfonyl]benzoic acid

Molecular Formula

C10H9NO4S

Molecular Mass

239.25

Cite this Page

3-[(2-Propyn-1-ylamino)sulfonyl]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=868238-01-1 (retrieved 2024-11-28) (CAS RN: 868238-01-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H9NO4S/c1-2-6-11-16(14,15)9-5-3-4-8(7-9)10(12)13/h1,3-5,7,11H,6H2,(H,12,13)

InChIKey

InChIKey=JXDOWVPMLOMFRR-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 3-[(2-propyn-1-ylamino)sulfonyl]-
  • Benzoic acid, 3-[(2-propynylamino)sulfonyl]-
  • 3-[(2-Propyn-1-ylamino)sulfonyl]benzoic acid

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