1-[(3-Chloro-2-methylphenyl)sulfonyl]-3-piperidinecarboxylic acid

CAS Registry Number®

1094630-92-8
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CAS Name

1-[(3-Chloro-2-methylphenyl)sulfonyl]-3-piperidinecarboxylic acid

Molecular Formula

C13H16ClNO4S

Molecular Mass

317.79

Cite this Page

1-[(3-Chloro-2-methylphenyl)sulfonyl]-3-piperidinecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1094630-92-8 (retrieved 2024-08-25) (CAS RN: 1094630-92-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H16ClNO4S/c1-9-11(14)5-2-6-12(9)20(18,19)15-7-3-4-10(8-15)13(16)17/h2,5-6,10H,3-4,7-8H2,1H3,(H,16,17)

InChIKey

InChIKey=ZKZAAQOSAHCUEV-UHFFFAOYSA-N

SMILES

S(=O)(=O)(N1CC(C(O)=O)CCC1)C2=C(C)C(Cl)=CC=C2

Canonical SMILES

O=C(O)C1CN(CCC1)S(=O)(=O)C=2C=CC=C(Cl)C2C

Other Names for this Substance

  • 3-Piperidinecarboxylic acid, 1-[(3-chloro-2-methylphenyl)sulfonyl]-
  • 1-[(3-Chloro-2-methylphenyl)sulfonyl]-3-piperidinecarboxylic acid