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Substance Name: 1-Azabicyclo(2.2.2)octan-3-one, 2-((3,4-dimethoxyphenyl)methyl)-, hydrochloride
RN: 103660-57-7
InChIKey: KDYDWTPNMWTMDG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H21-N-O3.Cl-H

Molecular Weight

  • 311.807
 
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Names and Synonyms

Synonyms

  • 2-((3,4-Dimethoxyphenyl)methyl)-1-azabicyclo(2.2.2)octan-3-one hydrochloride
  • 2-(3,4-Dimethoxybenzylidene)-3-oxyquinuclidine hydrochloride

Systematic Name

  • 1-Azabicyclo(2.2.2)octan-3-one, 2-((3,4-dimethoxyphenyl)methyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 103660-57-7

System Generated Number

  • 0103660577

Molecular Formulas

Molecular Formula

  • C16-H21-N-O3.Cl-H

Molecular Formula Fragments

  • C16-H21-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H21NO3.ClH/c1-19-14-4-3-11(10-15(14)20-2)9-13-16(18)12-5-7-17(13)8-6-12;/h3-4,10,12-13H,5-9H2,1-2H3;1H

InChIKey

KDYDWTPNMWTMDG-UHFFFAOYSA-N

Smiles

[NH+]12[C@@H](Cc3cc(c(OC)cc3)OC)C(C(CC1)CC2)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 248mg/kg (248mg/kg)   Pharmaceutical Chemistry Journal Vol. 20, Pg. 726, 1986.