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Substance Name: Ammonium, (4,4'-biphenylylenebis(2-oxoethylene))bis((2-ethoxyethyl)dimethyl-, dibromide
RN: 58594-13-1
InChIKey: ZIBXCOKSRSJVLA-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C28-H42-N2-O4.2Br

Molecular Weight

  • 630.458
 
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Names and Synonyms

Synonym

  • (4,4'-Biphenylylenebis(2-oxoethylene))bis((2-ethoxyethyl)dimethylammonium) dibromide

Systematic Name

  • Ammonium, (4,4'-biphenylylenebis(2-oxoethylene))bis((2-ethoxyethyl)dimethyl-, dibromide

Registry Numbers

CAS Registry Number

  • 58594-13-1

System Generated Number

  • 0058594131

Molecular Formulas

Molecular Formula

  • C28-H42-N2-O4.2Br

Molecular Formula Fragments

  • Br
  • C28-H42-N2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C28H42N2O4.2BrH/c1-7-33-19-17-29(3,4)27(31)21-23-9-13-25(14-10-23)26-15-11-24(12-16-26)22-28(32)30(5,6)18-20-34-8-2;;/h9-16H,7-8,17-22H2,1-6H3;2*1H/q+2;;/p-2

InChIKey

ZIBXCOKSRSJVLA-UHFFFAOYSA-L

Smiles

c1(c2ccc(CC([N+](CCOCC)(C)C)=O)cc2)ccc(CC([N+](CCOCC)(C)C)=O)cc1.[BrH-].[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1840ug/kg (1.84mg/kg) BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

BEHAVIORAL: ATAXIA
Journal of Medicinal Chemistry. Vol. 19, Pg. 760, 1976.