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Substance Name: Ketone, 3-hydroxy-1-methyl-3-piperidyl phenyl, benzoate (ester), hydrochloride, (+)-
RN: 33426-97-0
InChIKey: IXUBQARUVFRFLU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-N-O3.Cl-H

Molecular Weight

  • 359.851
 
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Names and Synonyms

Synonyms

  • (+)-1-Methyl-3-benzoyl-3-benzoyloxypiperidine hydrochloride
  • (+)-3-Hydroxy-1-methyl-3-piperidyl phenyl ketone benzoate (ester) hydrochloride

Systematic Name

  • Ketone, 3-hydroxy-1-methyl-3-piperidyl phenyl, benzoate (ester), hydrochloride, (+)-

Registry Numbers

CAS Registry Number

  • 33426-97-0

System Generated Number

  • 0033426970

Molecular Formulas

Molecular Formula

  • C20-H21-N-O3.Cl-H

Molecular Formula Fragments

  • C20-H21-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H21NO3.ClH/c1-21-14-8-13-20(15-21,18(22)16-9-4-2-5-10-16)24-19(23)17-11-6-3-7-12-17;/h2-7,9-12H,8,13-15H2,1H3;1H

InChIKey

IXUBQARUVFRFLU-UHFFFAOYSA-N

Smiles

C([C@@]1(OC(c2ccccc2)=O)C[N@@H+](CCC1)C)(c1ccccc1)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 180mg/kg (180mg/kg) BEHAVIORAL: ANALGESIA Journal of Pharmaceutical Sciences. Vol. 60, Pg. 685, 1971.