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Substance Name: Benzoic acid, 3-methoxy-2-propoxy-, 2-(diethylamino)ethyl ester, hydrochloride
RN: 23959-22-0
InChIKey: QUIQLMJJIBJLJL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H27-N-O4.Cl-H

Molecular Weight

  • 345.864
 
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Names and Synonyms

Synonym

  • 2-Propoxy-3-methoxybenzoic acid hydrochloride, 2-(diethylamino)ethyl ester

Systematic Name

  • Benzoic acid, 3-methoxy-2-propoxy-, 2-(diethylamino)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 23959-22-0

System Generated Number

  • 0023959220

Molecular Formulas

Molecular Formula

  • C17-H27-N-O4.Cl-H

Molecular Formula Fragments

  • C17-H27-N-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H27NO4.ClH/c1-5-12-21-16-14(9-8-10-15(16)20-4)17(19)22-13-11-18(6-2)7-3;/h8-10H,5-7,11-13H2,1-4H3;1H

InChIKey

QUIQLMJJIBJLJL-UHFFFAOYSA-N

Smiles

c1(c(C(OCC[NH+](CC)CC)=O)cccc1OC)OCCC.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 17mg/kg (17mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 870, 1969.