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Substance Name: 1H-Imidazolium, 1-((2,2-dimethyl-1-oxopropoxy)methyl)-2-((hydroxyimino)methyl)-3-methyl-, chloride
RN: 117941-44-3
InChIKey: PENBHHXSIXEFIR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H18-N3-O3.Cl

Molecular Weight

  • 275.7342
 
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Names and Synonyms

Synonyms

  • 1-(((2',2'-Dimethylpropanoyl)oxy)methyl)-2-((hydroxyimino)methyl)-3-methylimidazolium chloride
  • 1-((2,2-Dimethyl-1-oxopropoxy)methyl)-2-(hydroxyiminomethyl)-3-methyl-1H-imidazolium chloride

Systematic Name

  • 1H-Imidazolium, 1-((2,2-dimethyl-1-oxopropoxy)methyl)-2-((hydroxyimino)methyl)-3-methyl-, chloride

Registry Numbers

CAS Registry Number

  • 117941-44-3

System Generated Number

  • 0117941443

Molecular Formulas

Molecular Formula

  • C11-H18-N3-O3.Cl

Molecular Formula Fragments

  • C11-H18-N3-O3
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C11H17N3O3.ClH/c1-11(2,3)10(15)17-8-14-6-5-13(4)9(14)7-12-16;/h5-7H,8H2,1-4H3;1H

InChIKey

PENBHHXSIXEFIR-UHFFFAOYSA-N

Smiles

CC(C)(C)C(=O)OCn1cc[n+](c1/C=N/O)C.[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular 103mg/kg (103mg/kg)   Journal of Medicinal Chemistry. Vol. 32, Pg. 493, 1989.