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Substance Name: Pyridinium, 1-((3-butynyloxy)methyl)-4-((hydroxyimino)methyl)-, chloride
RN: 117983-02-5
InChIKey: OBNNFQUTTOFCRL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H13-N2-O2.Cl

Molecular Weight

  • 240.689
 
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Names and Synonyms

Synonym

  • 1-((3'-Butyn-1'-yloxy)methyl)-4-((hydroxyimino)methyl)pyridinium chloride

Systematic Name

  • Pyridinium, 1-((3-butynyloxy)methyl)-4-((hydroxyimino)methyl)-, chloride

Registry Numbers

CAS Registry Number

  • 117983-02-5

System Generated Number

  • 0117983025

Molecular Formulas

Molecular Formula

  • C11-H13-N2-O2.Cl

Molecular Formula Fragments

  • C11-H13-N2-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C11H12N2O2.ClH/c1-2-3-8-15-10-13-6-4-11(5-7-13)9-12-14;/h1,4-7,9H,3,8,10H2;1H

InChIKey

OBNNFQUTTOFCRL-UHFFFAOYSA-N

Smiles

C([n+]1ccc(cc1)\C=N\O)OCCC#C.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular 161mg/kg (161mg/kg)   Journal of Medicinal Chemistry. Vol. 32, Pg. 504, 1989.