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Substance Name: 3,9-Diazabicyclo(3.3.1)nonane, 3-benzyl-9-(2-(diethylamino)ethyl)-, dihydrochloride
RN: 23531-23-9
InChIKey: JDFVTEVOACZRQR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H33-N3.2Cl-H

Molecular Weight

  • 388.423
 
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Names and Synonyms

Synonyms

  • 3-Benzyl-9-(2-(diethylamino)ethyl)-3,9-diazabicyclo(3.3.1)nonane dihydrochloride
  • 3-Benzyl-N,N-diethyl-3,9-diazabicyclo(3.3.1)nonane-9-ethylamine dihydrochloride

Systematic Name

  • 3,9-Diazabicyclo(3.3.1)nonane, 3-benzyl-9-(2-(diethylamino)ethyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 23531-23-9

System Generated Number

  • 0023531239

Molecular Formulas

Molecular Formula

  • C20-H33-N3.2Cl-H

Molecular Formula Fragments

  • C20-H33-N3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H33N3.2ClH/c1-3-21(4-2)13-14-23-19-11-8-12-20(23)17-22(16-19)15-18-9-6-5-7-10-18;;/h5-7,9-10,19-20H,3-4,8,11-17H2,1-2H3;2*1H

InChIKey

JDFVTEVOACZRQR-UHFFFAOYSA-N

Smiles

[NH+]1([C@@H]2CN(Cc3ccccc3)C[C@@H]1CCC2)CC[NH+](CC)CC.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 27mg/kg (27mg/kg) AUTONOMIC NERVOUS SYSTEM: PARASYMPATHOLYTIC Pharmaceutical Chemistry Journal Vol. 3, Pg. 68, 1969.