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Substance Name: Benzoic acid, 4-amino-2-propoxy-, 3-(diethylamino)propyl ester, dihydrochloride
RN: 100311-13-5
InChIKey: IBCGTOOAMLYCQU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H28-N2-O3.2Cl-H

Molecular Weight

  • 381.341
 
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Names and Synonyms

Synonyms

  • 4-Amino-2-propoxybenzoic acid 3-(diethylamino)propyl ester dihydrochloride
  • WIN 3699

Systematic Name

  • Benzoic acid, 4-amino-2-propoxy-, 3-(diethylamino)propyl ester, dihydrochloride

Registry Numbers

CAS Registry Number

  • 100311-13-5

System Generated Number

  • 0100311135

Molecular Formulas

Molecular Formula

  • C17-H28-N2-O3.2Cl-H

Molecular Formula Fragments

  • C17-H28-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H28N2O3.2ClH/c1-4-11-21-16-13-14(18)8-9-15(16)17(20)22-12-7-10-19(5-2)6-3;;/h8-9,13H,4-7,10-12,18H2,1-3H3;2*1H

InChIKey

IBCGTOOAMLYCQU-UHFFFAOYSA-N

Smiles

c1(c(cc([NH2+])cc1)OCCC)C(OCCC[NH+](CC)CC)=O.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 6539ug/kg (6.539mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Pharmacology and Experimental Therapeutics. Vol. 104, Pg. 40, 1952.