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Substance Name: Isoquinolinium, 2-(2-(hydroxyimino)-2-phenylethyl)-, chloride
RN: 33860-81-0
InChIKey: NXXQDOFCUHEEAE-YBFBCAGJSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H15-N2-O.Cl

Molecular Weight

  • 298.772
 
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Names and Synonyms

Synonyms

  • 1-Phenacyloxime isoquinolinium chloride
  • 2-(2-(Hydroxyimino)-2-phenylethyl)isoquinolinium chloride

Systematic Name

  • Isoquinolinium, 2-(2-(hydroxyimino)-2-phenylethyl)-, chloride

Registry Numbers

CAS Registry Number

  • 33860-81-0

System Generated Number

  • 0033860810

Molecular Formulas

Molecular Formula

  • C17-H15-N2-O.Cl

Molecular Formula Fragments

  • C17-H15-N2-O
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C17H14N2O.ClH/c20-18-17(15-7-2-1-3-8-15)13-19-11-10-14-6-4-5-9-16(14)12-19;/h1-12H,13H2;1H/b18-17-;

InChIKey

NXXQDOFCUHEEAE-YBFBCAGJSA-N

Smiles

c12c(cc[n+](c1)C\C(c1ccccc1)=N\O)cccc2.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 81600ug/kg (81.6mg/kg) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION Acta Pharmaceutica Jugoslavica. Vol. 21, Pg. 113, 1971.