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Substance Name: 4-Piperidinol, 4-phenyl-5-piperidinomethyl-1,2,5-trimethyl-, cinnamate, dihydrochloride
RN: 36174-42-2
InChIKey: VKDOTPLDYGYMOA-QIKYXUGXSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H37-N2-O2.2Cl-H

Molecular Weight

  • 519.553
 
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Names and Synonyms

Synonym

  • 4-Hydroxy-4-phenyl-5-piperidinomethyl-1,2,5-trimethylpiperidine, cinnamate, dihydrochloride

Systematic Name

  • 4-Piperidinol, 4-phenyl-5-piperidinomethyl-1,2,5-trimethyl-, cinnamate, dihydrochloride

Registry Numbers

CAS Registry Number

  • 36174-42-2

System Generated Number

  • 0036174422

Molecular Formulas

Molecular Formula

  • C29-H37-N2-O2.2Cl-H

Molecular Formula Fragments

  • C29-H37-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C29H38N2O2.2ClH/c1-24-21-29(26-15-9-5-10-16-26,33-27(32)18-17-25-13-7-4-8-14-25)28(2,22-30(24)3)23-31-19-11-6-12-20-31;;/h4-5,7-10,13-18,24H,6,11-12,19-23H2,1-3H3;2*1H/b18-17+;;

InChIKey

VKDOTPLDYGYMOA-QIKYXUGXSA-N

Smiles

Cl.C(\C=C\c1ccccc1)(=O)O[C@@]1(C[C@@H]([N@@](C[C@@]1(CN1CCCCC1)C)C)C)c1ccccc1.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 550mg/kg (550mg/kg)   Russian Pharmacology and Toxicology Vol. 37, Pg. 153, 1974.