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Substance Name: Butyronitrile, 2-phenyl-4-piperidino-2-(2-piperidinoethyl)-
RN: 1241-76-5
InChIKey: HALDFVMYDWCMAP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H33-N3

Molecular Weight

  • 339.524
 
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Names and Synonyms

Synonyms

  • 2-Phenyl-4-piperidino-2-(2-piperidinoethyl)butyronitrile
  • 5-20-03-00317 (Beilstein Handbook Reference)
  • BRN 0307958

Systematic Name

  • Butyronitrile, 2-phenyl-4-piperidino-2-(2-piperidinoethyl)-

Registry Numbers

CAS Registry Number

  • 1241-76-5

System Generated Number

  • 0001241765

Structure Descriptors

InChI

1S/C22H33N3/c23-20-22(21-10-4-1-5-11-21,12-18-24-14-6-2-7-15-24)13-19-25-16-8-3-9-17-25/h1,4-5,10-11H,2-3,6-9,12-19H2

InChIKey

HALDFVMYDWCMAP-UHFFFAOYSA-N

Smiles

C(c1ccccc1)(CCN1CCCCC1)(CCN1CCCCC1)C#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 300mg/kg (300mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 589, 1965.