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Substance Name: 1H-Imidazolium, 1-(5-hexynyl)-2-((hydroxyimino)methyl)-3-methyl-, chloride
RN: 117982-95-3
InChIKey: CZSDGHVNIUROET-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H16-N3-O.Cl

Molecular Weight

  • 241.7204
 
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Names and Synonyms

Synonym

  • 1-(Hex-5'-yn-1'-yl)-2-((hydroxyimino)methyl)-3-methylimidazolium chloride

Systematic Name

  • 1H-Imidazolium, 1-(5-hexynyl)-2-((hydroxyimino)methyl)-3-methyl-, chloride

Registry Numbers

CAS Registry Number

  • 117982-95-3

System Generated Number

  • 0117982953

Molecular Formulas

Molecular Formula

  • C11-H16-N3-O.Cl

Molecular Formula Fragments

  • C11-H16-N3-O
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C11H15N3O.ClH/c1-3-4-5-6-7-14-9-8-13(2)11(14)10-12-15;/h1,8-10H,4-7H2,2H3;1H

InChIKey

CZSDGHVNIUROET-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular 97mg/kg (97mg/kg)   Journal of Medicinal Chemistry. Vol. 32, Pg. 504, 1989.