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Substance Name: Ammonium, o-chlorobenzyl(4-(o-chlorobenzylaminomethyl)cyclohexylmethyl)dimethyl-, iodide, (E)-
RN: 7043-67-6
InChIKey: FVMSYKRGNMQTLX-APKPHLMVSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H33-Cl2-N2.I

Molecular Weight

  • 547.345
 
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Names and Synonyms

Synonym

  • trans-o-Chlorobenzyl(4-(o-chlorobenzylaminomethyl)cyclohexylmethyl)dimethylammonium iodide

Systematic Name

  • Ammonium, o-chlorobenzyl(4-(o-chlorobenzylaminomethyl)cyclohexylmethyl)dimethyl-, iodide, (E)-

Registry Numbers

CAS Registry Number

  • 7043-67-6

System Generated Number

  • 0007043676

Molecular Formulas

Molecular Formula

  • C24-H33-Cl2-N2.I

Molecular Formula Fragments

  • C24-H33-Cl2-N2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C24H33Cl2N2.HI/c1-28(2,18-22-8-4-6-10-24(22)26)17-20-13-11-19(12-14-20)15-27-16-21-7-3-5-9-23(21)25;/h3-10,19-20,27H,11-18H2,1-2H3;1H/q+1;/p-1/t19-,20-;

InChIKey

FVMSYKRGNMQTLX-APKPHLMVSA-M

Smiles

c1(C[N+](C[C@H]2CC[C@H](CNCc3c(cccc3)Cl)CC2)(C)C)c(cccc1)Cl.[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 909mg/kg (909mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 329, 1966.