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Substance Name: Acetic acid, phenyl-, 3-(2,6-dimethylpiperidino)propyl ester, hydrochloride
RN: 66902-60-1
InChIKey: CTACUHYCOFPQTL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H27-N-O2.Cl-H

Molecular Weight

  • 325.877
 
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Names and Synonyms

Synonym

  • Phenylacetic acid 3-(2,6-dimethylpiperidino)propyl ester hydrochloride

Systematic Name

  • Acetic acid, phenyl-, 3-(2,6-dimethylpiperidino)propyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 66902-60-1

System Generated Number

  • 0066902601

Molecular Formulas

Molecular Formula

  • C18-H27-N-O2.Cl-H

Molecular Formula Fragments

  • C18-H27-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H27NO2.ClH/c1-15-8-6-9-16(2)19(15)12-7-13-21-18(20)14-17-10-4-3-5-11-17;/h3-5,10-11,15-16H,6-9,12-14H2,1-2H3;1H

InChIKey

CTACUHYCOFPQTL-UHFFFAOYSA-N

Smiles

[NH+]1([C@@H](CCC[C@@H]1C)C)CCCOC(Cc1ccccc1)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 28mg/kg (28mg/kg)   Journal of the American Chemical Society. Vol. 68, Pg. 2592, 1946.
mouse LD50 subcutaneous 710mg/kg (710mg/kg)   Journal of the American Chemical Society. Vol. 68, Pg. 2592, 1946.