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Substance Name: 1H-Imidazolium, 2-((hydroxyimino)methyl)-3-methyl-1-(((2-(2-(trifluoromethyl)phenyl)ethyl)oxy)methyl)-, chloride
RN: 117983-35-4
InChIKey: HUGHTPDCQLGIEK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H17-F3-N3-O2.Cl

Molecular Weight

  • 363.7653
 
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Names and Synonyms

  • 1H-Imidazolium, 2-((hydroxyimino)methyl)-3-methyl-1-(((2-(2-(trifluoromethyl)phenyl)ethyl)oxy)methyl)-, chloride

Registry Numbers

CAS Registry Number

  • 117983-35-4

System Generated Number

  • 0117983354

Molecular Formulas

Molecular Formula

  • C15-H17-F3-N3-O2.Cl

Molecular Formula Fragments

  • C15-H17-F3-N3-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C15H16F3N3O2.ClH/c1-20-7-8-21(14(20)10-19-22)11-23-9-6-12-4-2-3-5-13(12)15(16,17)18;/h2-5,7-8,10H,6,9,11H2,1H3;1H

InChIKey

HUGHTPDCQLGIEK-UHFFFAOYSA-N

Smiles

Cn1cc[n+](c1/C=N/O)COCCc2ccccc2C(F)(F)F.[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular 15643ug/kg (15.643mg/kg)   Journal of Medicinal Chemistry. Vol. 32, Pg. 504, 1989.