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Substance Name: Cyclopentanecarboxylic acid, 1-phenyl-, 4-(1-pyrrolidinyl)-2-butynyl ester, hydrochloride
RN: 17781-94-1
InChIKey: BTNBDRGYUSMWND-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H25-N-O2.Cl-H

Molecular Weight

  • 347.883
 
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Names and Synonyms

Synonym

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 17781-94-1

System Generated Number

  • 0017781941

Molecular Formulas

Molecular Formula

  • C20-H25-N-O2.Cl-H

Molecular Formula Fragments

  • C20-H25-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H25NO2.ClH/c22-19(23-17-9-8-16-21-14-6-7-15-21)20(12-4-5-13-20)18-10-2-1-3-11-18;/h1-3,10-11H,4-7,12-17H2;1H

InChIKey

BTNBDRGYUSMWND-UHFFFAOYSA-N

Smiles

C1(CCCC1)(C(=O)OCC#CCN1CCCC1)c1ccccc1.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 694mg/kg (694mg/kg)   Acta Pharmaceutica Suecica. Vol. 6, Pg. 349, 1969.