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Substance Name: Benzoic acid, 4-amino-2-chloro-, ester with 3-hydroxy-1-methyl-3-piperidyl phenyl ketone, monohydrochloride, (+-)-
RN: 33422-58-1
InChIKey: MLDRGBDROVDETR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-Cl-N2-O3.Cl-H

Molecular Weight

  • 409.311
 
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Names and Synonyms

Synonym

  • (+-)-1-Methyl-3-benzoyl-3-(o-chloro-p-aminobenzoyloxy)piperidine hydrochloride

Systematic Name

  • Benzoic acid, 4-amino-2-chloro-, ester with 3-hydroxy-1-methyl-3-piperidyl phenyl ketone, monohydrochloride, (+-)-

Registry Numbers

CAS Registry Number

  • 33422-58-1

System Generated Number

  • 0033422581

Molecular Formulas

Molecular Formula

  • C20-H21-Cl-N2-O3.Cl-H

Molecular Formula Fragments

  • C20-H21-Cl-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H21ClN2O3.ClH/c1-23-11-5-10-20(13-23,18(24)14-6-3-2-4-7-14)26-19(25)16-9-8-15(22)12-17(16)21;/h2-4,6-9,12H,5,10-11,13,22H2,1H3;1H

InChIKey

MLDRGBDROVDETR-UHFFFAOYSA-N

Smiles

C([C@@]1(OC(c2c(cc(N)cc2)Cl)=O)C[N@@H+](CCC1)C)(c1ccccc1)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 30mg/kg (30mg/kg) BEHAVIORAL: ANALGESIA Journal of Pharmaceutical Sciences. Vol. 60, Pg. 685, 1971.