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Substance Name: Ketone, phenyl 3-(piperidinomethyl)-1,4-benzodioxan-6-yl, hydrochloride
RN: 3818-98-2
InChIKey: QWVJQOXEEWGUTN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H23-N-O3.Cl-H

Molecular Weight

  • 373.878
 
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Names and Synonyms

Synonyms

  • Chlorhydrate de piperidinomethyl-2 benzoyl-7 benzodioxanne-1,4
  • Chlorhydrate de piperidinomethyl-2 benzoyl-7 benzodioxanne-1,4 [French]
  • CT 3570
  • Phenyl 3-(piperidinomethyl)-1,4-benzodioxan-6-yl ketone hydrochloride

Systematic Name

  • Ketone, phenyl 3-(piperidinomethyl)-1,4-benzodioxan-6-yl, hydrochloride

Registry Numbers

CAS Registry Number

  • 3818-98-2

System Generated Number

  • 0003818982

Molecular Formulas

Molecular Formula

  • C21-H23-N-O3.Cl-H

Molecular Formula Fragments

  • C21-H23-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H23NO3.ClH/c23-21(16-7-3-1-4-8-16)17-9-10-19-20(13-17)25-18(15-24-19)14-22-11-5-2-6-12-22;/h1,3-4,7-10,13,18H,2,5-6,11-12,14-15H2;1H

InChIKey

QWVJQOXEEWGUTN-UHFFFAOYSA-N

Smiles

c12c(ccc(c1)C(c1ccccc1)=O)OC[C@@H](O2)C[NH+]1CCCCC1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 400mg/kg (400mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 135, Pg. 462, 1962.