Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ketone, 6,7-dimethoxy-1-isoquinolyl 3,4-dimethoxyphenyl, O-(N-((2-morpholinoethyl)carbaniloyl)methyl)oxime, dihydrochloride
RN: 54022-69-4
InChIKey: MKXYHEQCWDIQHQ-PSXQHBSSSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C34-H38-N4-O7.2Cl-H

Molecular Weight

  • 687.617
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • Papaveraldine O-(N-(2-morpholinoethyl)carbaniloylmethyl)oxime dihydrochloride

Systematic Name

  • Ketone, 6,7-dimethoxy-1-isoquinolyl 3,4-dimethoxyphenyl, O-(N-((2-morpholinoethyl)carbaniloyl)methyl)oxime, dihydrochloride

Registry Numbers

CAS Registry Number

  • 54022-69-4

System Generated Number

  • 0054022694

Molecular Formulas

Molecular Formula

  • C34-H38-N4-O7.2Cl-H

Molecular Formula Fragments

  • C34-H38-N4-O7
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C34H38N4O7.2ClH/c1-40-28-11-10-25(21-29(28)41-2)33(34-27-22-31(43-4)30(42-3)20-24(27)12-13-35-34)36-45-23-32(39)38(26-8-6-5-7-9-26)15-14-37-16-18-44-19-17-37;;/h5-13,20-22H,14-19,23H2,1-4H3;2*1H/b36-33+;;

InChIKey

MKXYHEQCWDIQHQ-PSXQHBSSSA-N

Smiles

c1(c2c(cc(OC)c(c2)OC)cc[n+]1)\C(c1cc(c(OC)cc1)OC)=N\OCC(N(c1ccccc1)CC[NH+]1CCOCC1)=O.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1300mg/kg (1300mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 571, 1974.