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Substance Name: Benzoic acid, 2-ethoxy-3-methoxy-, 2-piperidinoethyl ester, hydrochloride
RN: 63938-75-0
InChIKey: NSSKAGXFUVOOHA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H25-N-O4.Cl-H

Molecular Weight

  • 343.848
 
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Names and Synonyms

Synonym

  • 2-Ethoxy-3-methoxybenzoic acid 2-piperidinoethyl ester hydrochloride

Systematic Name

  • Benzoic acid, 2-ethoxy-3-methoxy-, 2-piperidinoethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 63938-75-0

System Generated Number

  • 0063938750

Molecular Formulas

Molecular Formula

  • C17-H25-N-O4.Cl-H

Molecular Formula Fragments

  • C17-H25-N-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H25NO4.ClH/c1-3-21-16-14(8-7-9-15(16)20-2)17(19)22-13-12-18-10-5-4-6-11-18;/h7-9H,3-6,10-13H2,1-2H3;1H

InChIKey

NSSKAGXFUVOOHA-UHFFFAOYSA-N

Smiles

c1(c(C(OCC[NH+]2CCCCC2)=O)cccc1OC)OCC.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 55mg/kg (55mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 870, 1969.