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Substance Name: 2-Pyrrolidinone, 1-(4-piperidino-2-butynyl)-, oxalate (2:3)
RN: 18937-09-2
InChIKey: RHCUYOFXWXQXFK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H20-N2-O.3/2C2-H2-O4

Molecular Weight

  • 710.729
 
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Names and Synonyms

Synonyms

  • 1-(4-Piperidino-2-butynyl)-2-pyrrolidinone oxalate (2:3)
  • PN 305

Systematic Name

  • 2-Pyrrolidinone, 1-(4-piperidino-2-butynyl)-, oxalate (2:3)

Registry Numbers

CAS Registry Number

  • 18937-09-2

System Generated Number

  • 0018937092

Molecular Formulas

Molecular Formula

  • C13-H20-N2-O.3/2C2-H2-O4

Molecular Formula Fragments

  • C13-H20-N2-O
  • C2-H2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/2C13H20N2O.3C2H2O4/c2*16-13-7-6-12-15(13)11-5-4-10-14-8-2-1-3-9-14;3*3-1(4)2(5)6/h2*1-3,6-12H2;3*(H,3,4)(H,5,6)

InChIKey

RHCUYOFXWXQXFK-UHFFFAOYSA-N

Smiles

N1(CC#CCN2CCCCC2)C(CCC1)=O.C(C(=O)O)(=O)O.N1(CCCC1=O)CC#CCN1CCCCC1.C(C(=O)O)(=O)O.C(C(=O)O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 42mg/kg (42mg/kg)   Therapie. Vol. 22, Pg. 671, 1967.