Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzoic acid, 2-butoxy-3-methoxy-, 2-(butylamino)ethyl ester, hydrochloride
RN: 22684-78-2
InChIKey: MBGTZOAOUKGRQG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H29-N-O4.Cl-H

Molecular Weight

  • 359.891
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 2-Butoxy-3-methoxybenzoic acid hydrochloride, 2-(butylamino)ethyl ester

Systematic Name

  • Benzoic acid, 2-butoxy-3-methoxy-, 2-(butylamino)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 22684-78-2

System Generated Number

  • 0022684782

Molecular Formulas

Molecular Formula

  • C18-H29-N-O4.Cl-H

Molecular Formula Fragments

  • C18-H29-N-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H29NO4.ClH/c1-4-6-11-19-12-14-23-18(20)15-9-8-10-16(21-3)17(15)22-13-7-5-2;/h8-10,19H,4-7,11-14H2,1-3H3;1H

InChIKey

MBGTZOAOUKGRQG-UHFFFAOYSA-N

Smiles

c1(c(C(OCC[NH2+]CCCC)=O)cccc1OC)OCCCC.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 18mg/kg (18mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 870, 1969.