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Substance Name: Hippuric acid, beta-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride
RN: 79565-79-0
InChIKey: PFFVBMCSJLLAPT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H26-N2-O3.Cl-H

Molecular Weight

  • 390.908
 
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Names and Synonyms

Synonym

  • beta-Phenylhippuric acid 2-(diethylamino)ethyl ester hydrochloride

Systematic Name

  • Hippuric acid, beta-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 79565-79-0

System Generated Number

  • 0079565790

Molecular Formulas

Molecular Formula

  • C21-H26-N2-O3.Cl-H

Molecular Formula Fragments

  • C21-H26-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H26N2O3.ClH/c1-3-22(4-2)15-16-26-20(24)17-23(19-13-9-6-10-14-19)21(25)18-11-7-5-8-12-18;/h5-14H,3-4,15-17H2,1-2H3;1H

InChIKey

PFFVBMCSJLLAPT-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 537mg/kg (537mg/kg)   Bollettino Chimico Farmaceutico. Vol. 120, Pg. 208, 1981.