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Substance Name: 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3,3'-pentamethylenebis(9,9-dimethyl-, diiodide
RN: 102585-76-2
InChIKey: CYENOEXCQRGRMU-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H46-N4.2I

Molecular Weight

  • 632.444
 
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Names and Synonyms

Synonyms

  • 1,5-Bis(9-methyl-3,9-diazabicyclo-(3,3,1)-nonane-3)-pentane dimethiodide
  • 3,3'-Pentamethylenebis(9,9-dimethyl-3-aza-9-azoniabicyclo(3.3.1)nonane) diiodide

Systematic Name

  • 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3,3'-pentamethylenebis(9,9-dimethyl-, diiodide

Registry Numbers

CAS Registry Number

  • 102585-76-2

System Generated Number

  • 0102585762

Molecular Formulas

Molecular Formula

  • C23-H46-N4.2I

Molecular Formula Fragments

  • C23-H46-N4
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C23H46N4.2HI/c1-26(2)20-10-8-11-21(26)17-24(16-20)14-6-5-7-15-25-18-22-12-9-13-23(19-25)27(22,3)4;;/h20-23H,5-19H2,1-4H3;2*1H/q+2;;/p-2

InChIKey

CYENOEXCQRGRMU-UHFFFAOYSA-L

Smiles

[N+]1([C@@H]2CN(CCCCCN3C[C@@H]4[N+](C)(C)[C@@H](C3)CCC4)C[C@@H]1CCC2)(C)C.[IH-].[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 759ug/kg (0.759mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

LUNGS, THORAX, OR RESPIRATION: CYANOSIS
Journal of Medicinal and Pharmaceutical Chemistry. Vol. 3, Pg. 441, 1961.