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Substance Name: 1H-Imidazolium, 1-(((4,4-dimethyl-2-pentenyl)oxy)methyl)-2-((hydroxyimino)methyl)-3-methyl-, chloride
RN: 117983-13-8
InChIKey: PIQJDEVYMFYSFZ-IPZCTEOASA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H22-N3-O2.Cl

Molecular Weight

  • 287.7888
 
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Names and Synonyms

Synonym

  • 1-(((4,4-Dimethyl-2-pentenyl)oxy)methyl)-2-((hydroxyimino)methyl)-3-methylimidazolium Cl

Systematic Name

  • 1H-Imidazolium, 1-(((4,4-dimethyl-2-pentenyl)oxy)methyl)-2-((hydroxyimino)methyl)-3-methyl-, chloride

Registry Numbers

CAS Registry Number

  • 117983-13-8

System Generated Number

  • 0117983138

Molecular Formulas

Molecular Formula

  • C13-H22-N3-O2.Cl

Molecular Formula Fragments

  • C13-H22-N3-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C13H21N3O2.ClH/c1-13(2,3)6-5-9-18-11-16-8-7-15(4)12(16)10-14-17;/h5-8,10H,9,11H2,1-4H3;1H/b6-5+;

InChIKey

PIQJDEVYMFYSFZ-IPZCTEOASA-N

Smiles

CC(C)(C)/C=C/COCn1cc[n+](c1/C=N/O)C.[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular 89218ug/kg (89.218mg/kg)   Journal of Medicinal Chemistry. Vol. 32, Pg. 504, 1989.