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Substance Name: Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride
RN: 63992-55-2
InChIKey: GMTRMRXFOWCLAM-GEEYTBSJSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H27-N-O2.Cl-H

Molecular Weight

  • 373.921
 
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Names and Synonyms

Synonyms

  • 2-(Diethylamino)ethyl ester of 4,4-diphenylcrotonic acid hydrochloride
  • 4,4-Diphenylcrotonic acid 2-(diethylamino)ethyl ester hydrochloride

Systematic Name

  • Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 63992-55-2

System Generated Number

  • 0063992552

Molecular Formulas

Molecular Formula

  • C22-H27-N-O2.Cl-H

Molecular Formula Fragments

  • C22-H27-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H27NO2.ClH/c1-3-23(4-2)17-18-25-22(24)16-15-21(19-11-7-5-8-12-19)20-13-9-6-10-14-20;/h5-16,21H,3-4,17-18H2,1-2H3;1H/b16-15+;

InChIKey

GMTRMRXFOWCLAM-GEEYTBSJSA-N

Smiles

C(c1ccccc1)(c1ccccc1)\C=C\C(OCC[NH+](CC)CC)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 710mg/kg (710mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 74, Pg. 274, 1942.