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Substance Name: Ketone, 6,7-dimethoxy-1-isoquinolyl 3,4-dimethoxyphenyl, O-((2-diethylamino)ethyl)oxime, dihydrochloride
RN: 54022-65-0
InChIKey: WFJKULNGRMDNJG-FJZULJNHSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H33-N3-O5.2Cl-H

Molecular Weight

  • 540.484
 
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Names and Synonyms

Synonyms

  • Dichlorhydrate de ((diethylamino)-2 ethyl)-oxyimino-papaverine
  • Dichlorhydrate de ((diethylamino)-2 ethyl)-oxyimino-papaverine [French]
  • Papaveraldine O-((2-diethylamino)ethyl)oxime dihydrochloride

Systematic Name

  • Ketone, 6,7-dimethoxy-1-isoquinolyl 3,4-dimethoxyphenyl, O-((2-diethylamino)ethyl)oxime, dihydrochloride

Registry Numbers

CAS Registry Number

  • 54022-65-0

System Generated Number

  • 0054022650

Molecular Formulas

Molecular Formula

  • C26-H33-N3-O5.2Cl-H

Molecular Formula Fragments

  • C26-H33-N3-O5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C26H33N3O5.2ClH/c1-7-29(8-2)13-14-34-28-25(19-9-10-21(30-3)22(16-19)31-4)26-20-17-24(33-6)23(32-5)15-18(20)11-12-27-26;;/h9-12,15-17H,7-8,13-14H2,1-6H3;2*1H/b28-25+;;

InChIKey

WFJKULNGRMDNJG-FJZULJNHSA-N

Smiles

c1(c2c(cc(OC)c(c2)OC)cc[n+]1)\C(c1cc(c(OC)cc1)OC)=N\OCC[NH+](CC)CC.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 400mg/kg (400mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 571, 1974.