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Substance Name: 1-Piperazineheptanoic acid, 4-(2-methoxyphenyl)-, ethyl ester, dihydrochloride
RN: 81186-05-2
InChIKey: MJURRVGRIQWKFL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H32-N2-O3.2Cl-H

Molecular Weight

  • 421.4056
 
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Names and Synonyms

Synonyms

  • 1-(6-Ethoxycarbonylhexyl)-4-(o-methoxyphenyl)piperazine dihydrochloride
  • Ethyl 4-(2-methoxyphenyl)-1-piperazineheptanoate dihydrochloride

Systematic Name

  • 1-Piperazineheptanoic acid, 4-(2-methoxyphenyl)-, ethyl ester, dihydrochloride

Registry Numbers

CAS Registry Number

  • 81186-05-2

Related Registry Number

  • 81185-85-5 (Parent)

System Generated Number

  • 0081186052

Molecular Formulas

Molecular Formula

  • C20-H32-N2-O3.2Cl-H

Molecular Formula Fragments

  • C20-H32-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H32N2O3.2ClH/c1-3-25-20(23)12-6-4-5-9-13-21-14-16-22(17-15-21)18-10-7-8-11-19(18)24-2;;/h7-8,10-11H,3-6,9,12-17H2,1-2H3;2*1H

InChIKey

MJURRVGRIQWKFL-UHFFFAOYSA-N

Smiles

CCOC(=O)CCCCCCN1CCN(CC1)c2ccccc2OC.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD oral > 400mg/kg (400mg/kg)   United States Patent Document. Vol. #4438115,