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Substance Name: Ketone, 3-hydroxy-1-isopropyl-3-piperidyl phenyl, benzoate (ester), hydrochloride, (+-)-
RN: 33422-64-9
InChIKey: HTCNYINKTNPFBW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H25-N-O3.Cl-H

Molecular Weight

  • 387.904
 
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Names and Synonyms

Synonyms

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 33422-64-9

System Generated Number

  • 0033422649

Molecular Formulas

Molecular Formula

  • C22-H25-N-O3.Cl-H

Molecular Formula Fragments

  • C22-H25-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H25NO3.ClH/c1-17(2)23-15-9-14-22(16-23,20(24)18-10-5-3-6-11-18)26-21(25)19-12-7-4-8-13-19;/h3-8,10-13,17H,9,14-16H2,1-2H3;1H

InChIKey

HTCNYINKTNPFBW-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 32mg/kg (32mg/kg) BEHAVIORAL: ANALGESIA Journal of Pharmaceutical Sciences. Vol. 60, Pg. 685, 1971.