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Substance Name: 1H-Imidazolium, 2-((hydroxyimino)methyl)-3-methyl-1-((3-pentynyloxy)methyl)-, chloride
RN: 117983-26-3
InChIKey: JDXZSRSZRAVCBV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H16-N3-O2.Cl

Molecular Weight

  • 257.7194
 
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Names and Synonyms

Synonym

  • 2-((Hydroxyimino)methyl)-3-methyl-1-((3'-pentyn-1'-yloxy)methyl)imidazolium chloride

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 117983-26-3

System Generated Number

  • 0117983263

Molecular Formulas

Molecular Formula

  • C11-H16-N3-O2.Cl

Molecular Formula Fragments

  • C11-H16-N3-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C11H15N3O2.ClH/c1-3-4-5-8-16-10-14-7-6-13(2)11(14)9-12-15;/h6-7,9H,5,8,10H2,1-2H3;1H

InChIKey

JDXZSRSZRAVCBV-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular 235mg/kg (235mg/kg)   Journal of Medicinal Chemistry. Vol. 32, Pg. 504, 1989.