Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzoic acid, 3-(N-methyl-N-(3-phenylpropyl)amino)propyl ester, hydrochloride
RN: 67031-88-3
InChIKey: HSHNPDSYFRLHRP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H25-N-O2.Cl-H

Molecular Weight

  • 347.883
 
* 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

  • Benzoic acid, 3-(N-methyl-N-(3-phenylpropyl)amino)propyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 67031-88-3

System Generated Number

  • 0067031883

Molecular Formulas

Molecular Formula

  • C20-H25-N-O2.Cl-H

Molecular Formula Fragments

  • C20-H25-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H25NO2.ClH/c1-21(15-8-12-18-10-4-2-5-11-18)16-9-17-23-20(22)19-13-6-3-7-14-19;/h2-7,10-11,13-14H,8-9,12,15-17H2,1H3;1H

InChIKey

HSHNPDSYFRLHRP-UHFFFAOYSA-N

Smiles

c1(C(OCCC[N@@H+](CCCc2ccccc2)C)=O)ccccc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo subcutaneous 1500mg/kg (1500mg/kg)   Journal of the American Chemical Society. Vol. 53, Pg. 1587, 1931.
rat LDLo intravenous 50mg/kg (50mg/kg)   Journal of the American Chemical Society. Vol. 53, Pg. 1587, 1931.