4-(Methylsulfonyl)-3-(1-piperidinyl)benzoic acid

CAS Registry Number®

1000018-47-2
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CAS Name

4-(Methylsulfonyl)-3-(1-piperidinyl)benzoic acid

Molecular Formula

C13H17NO4S

Molecular Mass

283.34

Cite this Page

4-(Methylsulfonyl)-3-(1-piperidinyl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1000018-47-2 (retrieved 2024-05-19) (CAS RN: 1000018-47-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H17NO4S/c1-19(17,18)12-6-5-10(13(15)16)9-11(12)14-7-3-2-4-8-14/h5-6,9H,2-4,7-8H2,1H3,(H,15,16)

InChIKey

InChIKey=CBYNXNKBSCPATK-UHFFFAOYSA-N

SMILES

S(C)(=O)(=O)C1=C(C=C(C(O)=O)C=C1)N2CCCCC2

Canonical SMILES

O=C(O)C1=CC=C(C(=C1)N2CCCCC2)S(=O)(=O)C

Other Names for this Substance

  • Benzoic acid, 4-(methylsulfonyl)-3-(1-piperidinyl)-
  • 4-(Methylsulfonyl)-3-(1-piperidinyl)benzoic acid

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