4-(Methylsulfonyl)-2-(1-piperazinyl)benzoic acid

CAS Registry Number®

1197193-32-0

CAS Name

4-(Methylsulfonyl)-2-(1-piperazinyl)benzoic acid

Molecular Formula

C12H16N2O4S

Molecular Mass

284.33

Cite this Page

4-(Methylsulfonyl)-2-(1-piperazinyl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1197193-32-0 (retrieved 2024-11-28) (CAS RN: 1197193-32-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H16N2O4S/c1-19(17,18)9-2-3-10(12(15)16)11(8-9)14-6-4-13-5-7-14/h2-3,8,13H,4-7H2,1H3,(H,15,16)

InChIKey

InChIKey=ASKWQQQKWKPTSH-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=C(C=C(S(C)(=O)=O)C=C1)N2CCNCC2

Canonical SMILES

O=C(O)C1=CC=C(C=C1N2CCNCC2)S(=O)(=O)C

Other Names for this Substance

  • Benzoic acid, 4-(methylsulfonyl)-2-(1-piperazinyl)-
  • 4-(Methylsulfonyl)-2-(1-piperazinyl)benzoic acid

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