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Substance Name: Piperazine, 1-(3-(1,3-benzodioxol-5-yl)-1-oxo-2-butenyl)-4-(2-oxo-2-(1-pyrrolidinyl)ethyl)-, monohydrochloride, (E)-
RN: 97181-25-4
InChIKey: GGBJGNAUXNOVAV-CLNHMMGSSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H27-N3-O4.Cl-H

Molecular Weight

  • 421.9222
 
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Names and Synonyms

  • Piperazine, 1-(3-(1,3-benzodioxol-5-yl)-1-oxo-2-butenyl)-4-(2-oxo-2-(1-pyrrolidinyl)ethyl)-, monohydrochloride, (E)-

Registry Numbers

CAS Registry Number

  • 97181-25-4

System Generated Number

  • 0097181254

Molecular Formulas

Molecular Formula

  • C21-H27-N3-O4.Cl-H

Molecular Formula Fragments

  • C21-H27-N3-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H27N3O4.ClH/c1-16(17-4-5-18-19(13-17)28-15-27-18)12-20(25)24-10-8-22(9-11-24)14-21(26)23-6-2-3-7-23;/h4-5,12-13H,2-3,6-11,14-15H2,1H3;1H/b16-12+;

InChIKey

GGBJGNAUXNOVAV-CLNHMMGSSA-N

Smiles

C/C(=C\C(=O)N1CCN(CC1)CC(=O)N2CCCC2)/c3ccc4c(c3)OCO4.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 400mg/kg (400mg/kg)   United States Patent Document. Vol. #4808582,