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Substance Name: 1H-Imidazolium, 1-(((3-butyn-2-yl)oxy)methyl)-2-((hydroxyimino)methyl)-3-methyl-, chloride
RN: 117983-19-4
InChIKey: SHPYNJLRHRZXBW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H14-N3-O2.Cl

Molecular Weight

  • 243.6926
 
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Names and Synonyms

Synonym

  • 1-((3'-Butyn-2'-yloxy)methyl)-2-((hydroxyimino)methyl)-3-methylimidazolium chloride

Systematic Name

  • 1H-Imidazolium, 1-(((3-butyn-2-yl)oxy)methyl)-2-((hydroxyimino)methyl)-3-methyl-, chloride

Registry Numbers

CAS Registry Number

  • 117983-19-4

System Generated Number

  • 0117983194

Molecular Formulas

Molecular Formula

  • C10-H14-N3-O2.Cl

Molecular Formula Fragments

  • C10-H14-N3-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C10H13N3O2.ClH/c1-4-9(2)15-8-13-6-5-12(3)10(13)7-11-14;/h1,5-7,9H,8H2,2-3H3;1H

InChIKey

SHPYNJLRHRZXBW-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular 65800ug/kg (65.8mg/kg)   Journal of Medicinal Chemistry. Vol. 32, Pg. 504, 1989.