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Substance Name: Heptanoic acid, 2-phenyl-, 3-(diethylamino)propyl ester, hydrochloride
RN: 78265-99-3
InChIKey: UTLQFNPZWCRAIP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H33-N-O2.Cl-H

Molecular Weight

  • 355.947
 
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Names and Synonyms

Synonyms

  • (3-(Diethylamino)propyl) 2-phenylheptanoate hydrochloride
  • Benzeneacetic acid, alpha-pentyl-, 3-(diethylamino)propyl ester, hydrochloride
  • C 2000

Systematic Name

  • Heptanoic acid, 2-phenyl-, 3-(diethylamino)propyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 78265-99-3

System Generated Number

  • 0078265993

Molecular Formulas

Molecular Formula

  • C20-H33-N-O2.Cl-H

Molecular Formula Fragments

  • C20-H33-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H33NO2.ClH/c1-4-7-9-15-19(18-13-10-8-11-14-18)20(22)23-17-12-16-21(5-2)6-3;/h8,10-11,13-14,19H,4-7,9,12,15-17H2,1-3H3;1H

InChIKey

UTLQFNPZWCRAIP-UHFFFAOYSA-N

Smiles

c1([C@@H](C(OCCC[NH+](CC)CC)=O)CCCCC)ccccc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 20mg/kg (20mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 11, Pg. 1119, 1961.