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Substance Name: Benzoic acid, 4-amino-2-butoxy-, 3-(diethylamino)propyl ester, dihydrochloride
RN: 100347-85-1
InChIKey: NQSKEHPRHKAEGD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H30-N2-O3.2Cl-H

Molecular Weight

  • 395.368
 
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Names and Synonyms

Synonyms

  • 4-Amino-2-butoxy-benzoic acid 3-(diethylamino)propyl ester dihydrochloride
  • WIN 3700

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 100347-85-1

System Generated Number

  • 0100347851

Molecular Formulas

Molecular Formula

  • C18-H30-N2-O3.2Cl-H

Molecular Formula Fragments

  • C18-H30-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H30N2O3.2ClH/c1-4-7-12-22-17-14-15(19)9-10-16(17)18(21)23-13-8-11-20(5-2)6-3;;/h9-10,14H,4-8,11-13,19H2,1-3H3;2*1H

InChIKey

NQSKEHPRHKAEGD-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 3656ug/kg (3.656mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

VASCULAR: BP LOWERING NOT CHARACTERIZED IN AUTONOMIC SECTION
Journal of Pharmacology and Experimental Therapeutics. Vol. 123, Pg. 269, 1958.