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Substance Name: Cyclopentanecarboxylic acid, 1-phenyl-, 4-(diethylamino)-2-butynyl ester, hydrochloride
RN: 17781-95-2
InChIKey: ZWATXJNMDZYTBD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H27-N-O2.Cl-H

Molecular Weight

  • 349.899
 
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Names and Synonyms

Synonym

  • 1-Phenylcyclopentanecarboxylic acid 4-(diethylamino)-2-butynyl ester hydrochloride

Systematic Name

  • Cyclopentanecarboxylic acid, 1-phenyl-, 4-(diethylamino)-2-butynyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 17781-95-2

System Generated Number

  • 0017781952

Molecular Formulas

Molecular Formula

  • C20-H27-N-O2.Cl-H

Molecular Formula Fragments

  • C20-H27-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H27NO2.ClH/c1-3-21(4-2)16-10-11-17-23-19(22)20(14-8-9-15-20)18-12-6-5-7-13-18;/h5-7,12-13H,3-4,8-9,14-17H2,1-2H3;1H

InChIKey

ZWATXJNMDZYTBD-UHFFFAOYSA-N

Smiles

C1(CCCC1)(C(=O)OCC#CCN(CC)CC)c1ccccc1.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 350mg/kg (350mg/kg)   Acta Pharmaceutica Suecica. Vol. 6, Pg. 349, 1969.