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

CAS Registry Number®

1197193-17-1

CAS Name

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

Molecular Formula

C12H15NO4S

Molecular Mass

269.32

Cite this Page

4-(Methylsulfonyl)-2-(1-pyrrolidinyl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1197193-17-1 (retrieved 2024-11-22) (CAS RN: 1197193-17-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H15NO4S/c1-18(16,17)9-4-5-10(12(14)15)11(8-9)13-6-2-3-7-13/h4-5,8H,2-3,6-7H2,1H3,(H,14,15)

InChIKey

InChIKey=CXDBUSOKXGSVLF-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=C(C=C(S(C)(=O)=O)C=C1)N2CCCC2

Canonical SMILES

O=C(O)C1=CC=C(C=C1N2CCCC2)S(=O)(=O)C

Other Names for this Substance

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

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