Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzoic acid, p-(butylamino)-, 2-hydroxy-3-(phenylamino)propyl ester, hydrochloride
RN: 100311-25-9
InChIKey: DBGHQQOLLYATEI-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H26-N2-O3.Cl-H

Molecular Weight

  • 377.889
 
* 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-Hydroxy-3-(phenylamino)propyl p-(butylamino)benzoate hydrochloride

Systematic Name

  • Benzoic acid, p-(butylamino)-, 2-hydroxy-3-(phenylamino)propyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 100311-25-9

System Generated Number

  • 0100311259

Molecular Formulas

Molecular Formula

  • C20-H26-N2-O3.Cl-H

Molecular Formula Fragments

  • C20-H26-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H26N2O3.ClH/c1-2-3-13-21-18-11-9-16(10-12-18)20(24)25-15-19(23)14-22-17-7-5-4-6-8-17;/h4-12,19,21-23H,2-3,13-15H2,1H3;1H/p-1

InChIKey

DBGHQQOLLYATEI-UHFFFAOYSA-M

Smiles

c1(ccc(NCCCC)cc1)C(OC[C@@H](CNc1ccccc1)O)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 5mg/kg (5mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 17, Pg. 1491, 1967.