4-Methyl-3-[(methylsulfonyl)amino]benzoic acid

CAS Registry Number®

450368-33-9

CAS Name

4-Methyl-3-[(methylsulfonyl)amino]benzoic acid

Molecular Formula

C9H11NO4S

Molecular Mass

229.25

Cite this Page

4-Methyl-3-[(methylsulfonyl)amino]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=450368-33-9 (retrieved 2024-10-07) (CAS RN: 450368-33-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H11NO4S/c1-6-3-4-7(9(11)12)5-8(6)10-15(2,13)14/h3-5,10H,1-2H3,(H,11,12)

InChIKey

InChIKey=QIQLVVVOWQKYAU-UHFFFAOYSA-N

SMILES

N(S(C)(=O)=O)C1=CC(C(O)=O)=CC=C1C

Canonical SMILES

O=C(O)C1=CC=C(C(=C1)NS(=O)(=O)C)C

Other Names for this Substance

  • Benzoic acid, 4-methyl-3-[(methylsulfonyl)amino]-
  • 4-Methyl-3-[(methylsulfonyl)amino]benzoic acid
  • 3-Methanesulfonylamino-4-methylbenzoic acid
  • 3-Methanesulfonamido-4-methylbenzoic acid

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