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Substance Name: Benzhydrol, alpha-(2-(diallylamino)-1-methylethyl)-, hydrochloride
RN: 78110-05-1
InChIKey: GVPCIKNKTAELAB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H27-N-O.Cl-H

Molecular Weight

  • 357.9222
 
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Names and Synonyms

Synonyms

  • 1,1-Diphenyl-2-methyl-3-(diallylamino)propanol hydrochloride
  • alpha-(2-(Diallylamino)-1-methylethyl)benzhydrol hydrochloride

Systematic Name

  • Benzhydrol, alpha-(2-(diallylamino)-1-methylethyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 78110-05-1

System Generated Number

  • 0078110051

Molecular Formulas

Molecular Formula

  • C22-H27-N-O.Cl-H

Molecular Formula Fragments

  • C22-H27-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H27NO.ClH/c1-4-16-23(17-5-2)18-19(3)22(24,20-12-8-6-9-13-20)21-14-10-7-11-15-21;/h4-15,19,24H,1-2,16-18H2,3H3;1H

InChIKey

GVPCIKNKTAELAB-UHFFFAOYSA-N

Smiles

CC(CN(CC=C)CC=C)C(c1ccccc1)(c2ccccc2)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 178mg/kg (178mg/kg)   Journal of Medicinal Chemistry. Vol. 14, Pg. 1106, 1971.