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Substance Name: Quinuclidinol, alpha-allyldiphenylacetate hydrochloride
RN: 63716-46-1
InChIKey: IMDUVPGBKGDXEX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H27-N-O2.Cl-H

Molecular Weight

  • 397.9432
 
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Names and Synonyms

Synonyms

  • Benzeneacetic acid, alpha-phenyl-alpha-2-propenyl-, 1-azabicyclo(2.2.2)octyl ester, HCl
  • Ro 2-3802

Systematic Name

  • Quinuclidinol, alpha-allyldiphenylacetate hydrochloride

Registry Numbers

CAS Registry Number

  • 63716-46-1

System Generated Number

  • 0063716461

Molecular Formulas

Molecular Formula

  • C24-H27-N-O2.Cl-H

Molecular Formula Fragments

  • C24-H27-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C24H27NO2.ClH/c1-2-15-24(20-9-5-3-6-10-20,21-11-7-4-8-12-21)23(26)27-22-18-19-13-16-25(22)17-14-19;/h2-12,19,22H,1,13-18H2;1H

InChIKey

IMDUVPGBKGDXEX-UHFFFAOYSA-N

Smiles

C=CCC(c1ccccc1)(c2ccccc2)C(=O)OC3CC4CCN3CC4.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 132mg/kg (132mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 104, Pg. 284, 1952.