Bepotastine

CAS Registry Number®

125602-71-3
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CAS Name

Bepotastine

Molecular Formula

C21H25ClN2O3

Molecular Mass

388.89

Cite this Page

Bepotastine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=190786-43-7 (retrieved 2024-03-05) (CAS RN: 125602-71-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H25ClN2O3/c22-17-8-6-16(7-9-17)21(19-4-1-2-12-23-19)27-18-10-14-24(15-11-18)13-3-5-20(25)26/h1-2,4,6-9,12,18,21H,3,5,10-11,13-15H2,(H,25,26)/t21-/m0/s1

InChIKey

InChIKey=YWGDOWXRIALTES-NRFANRHFSA-N

SMILES

[C@H](OC1CCN(CCCC(O)=O)CC1)(C2=CC=C(Cl)C=C2)C3=CC=CC=N3

Canonical SMILES

O=C(O)CCCN1CCC(OC(C2=NC=CC=C2)C3=CC=C(Cl)C=C3)CC1

Other Names for this Substance

  • 1-Piperidinebutanoic acid, 4-[(S)-(4-chlorophenyl)-2-pyridinylmethoxy]-
  • 4-[(S)-(4-Chlorophenyl)-2-pyridinylmethoxy]-1-piperidinebutanoic acid
  • Bepotastine
  • (S)-Bepotastine
  • (S)-4-[4-(4-chlorophenyl-2-pyridylmethoxy)piperidinyl]butyric acid

Deleted or Replaced CAS Registry Numbers

190786-43-7

CAS INSIGHTSTM
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