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Substance Name: Ammonium, (terephthaloyldimethylene)bis(((2-cyano-2-hydroxycyclohexyl)methyl)dimethyl-, dibromide
RN: 28003-37-4
InChIKey: XUUJYSXXRUOIIC-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H44-N4-O4.2Br

Molecular Weight

  • 684.51
 
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Names and Synonyms

  • Ammonium, (terephthaloyldimethylene)bis(((2-cyano-2-hydroxycyclohexyl)methyl)dimethyl-, dibromide

Registry Numbers

CAS Registry Number

  • 28003-37-4

System Generated Number

  • 0028003374

Molecular Formulas

Molecular Formula

  • C30-H44-N4-O4.2Br

Molecular Formula Fragments

  • Br
  • C30-H44-N4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C30H44N4O4.2BrH/c1-33(2,17-25-9-5-7-15-29(25,37)21-31)19-27(35)23-11-13-24(14-12-23)28(36)20-34(3,4)18-26-10-6-8-16-30(26,38)22-32;;/h11-14,25-26,37-38H,5-10,15-20H2,1-4H3;2*1H/q+2;;/p-2

InChIKey

XUUJYSXXRUOIIC-UHFFFAOYSA-L

Smiles

C([C@@H]1[C@@](CCCC1)(C#N)O)[N+](CC(c1ccc(C(C[N+](C[C@@H]2[C@@](CCCC2)(C#N)O)(C)C)=O)cc1)=O)(C)C.[BrH-].[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 2880ug/kg (2.88mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
European Journal of Pharmacology. Vol. 8, Pg. 127, 1969.