3-[[(Phenylmethyl)sulfonyl]amino]benzoic acid

CAS Registry Number®

860699-55-4
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CAS Name

3-[[(Phenylmethyl)sulfonyl]amino]benzoic acid

Molecular Formula

C14H13NO4S

Molecular Mass

291.32

Cite this Page

3-[[(Phenylmethyl)sulfonyl]amino]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=860699-55-4 (retrieved 2024-08-24) (CAS RN: 860699-55-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    205-206 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C14H13NO4S/c16-14(17)12-7-4-8-13(9-12)15-20(18,19)10-11-5-2-1-3-6-11/h1-9,15H,10H2,(H,16,17)

InChIKey

InChIKey=QIKUOKKSPSEHEY-UHFFFAOYSA-N

SMILES

N(S(CC1=CC=CC=C1)(=O)=O)C2=CC(C(O)=O)=CC=C2

Canonical SMILES

O=C(O)C=1C=CC=C(C1)NS(=O)(=O)CC=2C=CC=CC2

Other Names for this Substance

  • Benzoic acid, 3-[[(phenylmethyl)sulfonyl]amino]-
  • Benzoic acid, m-α-toluenesulfonamido-
  • 3-[[(Phenylmethyl)sulfonyl]amino]benzoic acid
  • 3-Phenylmethanesulfonamidobenzoic acid