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Substance Name: Acetic acid, 2,2-diphenyl-2-ethoxy-, (1-methyl-3-piperidyl) ester, hydrochloride
RN: 3138-70-3
InChIKey: VZIZQTPWDZQUNQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H27-N-O3.Cl-H

Molecular Weight

  • 389.92
 
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Names and Synonyms

Synonym

  • 2,2-Diphenyl-2-ethoxyacetic acid (1-methyl-3-piperidyl) ester hydrochloride

Systematic Name

  • Acetic acid, 2,2-diphenyl-2-ethoxy-, (1-methyl-3-piperidyl) ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 3138-70-3

System Generated Number

  • 0003138703

Molecular Formulas

Molecular Formula

  • C22-H27-N-O3.Cl-H

Molecular Formula Fragments

  • C22-H27-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H27NO3.ClH/c1-3-25-22(18-11-6-4-7-12-18,19-13-8-5-9-14-19)21(24)26-20-15-10-16-23(2)17-20;/h4-9,11-14,20H,3,10,15-17H2,1-2H3;1H

InChIKey

VZIZQTPWDZQUNQ-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 40mg/kg (40mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 571, 1965.