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Substance Name: 1H-Imidazolium, 2-((hydroxyimino)methyl)-1-methyl-3-((1-oxobutoxy)methyl)-, chloride
RN: 117941-68-1
InChIKey: AJQVMXQHGRFBIE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H16-N3-O3.Cl

Molecular Weight

  • 261.7074
 
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Names and Synonyms

Synonym

  • 1-((Butanoyloxy)methyl)-2-((hydroxyimino)methyl)-3-methylimidazolium chloride

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 117941-68-1

System Generated Number

  • 0117941681

Molecular Formulas

Molecular Formula

  • C10-H16-N3-O3.Cl

Molecular Formula Fragments

  • C10-H16-N3-O3
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C10H15N3O3.ClH/c1-3-4-10(14)16-8-13-6-5-12(2)9(13)7-11-15;/h5-7H,3-4,8H2,1-2H3;1H

InChIKey

AJQVMXQHGRFBIE-UHFFFAOYSA-N

Smiles

CCCC(=O)OC[n+]1ccn(c1/C=N/O)C.[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular 134mg/kg (134mg/kg)   Journal of Medicinal Chemistry. Vol. 32, Pg. 493, 1989.