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Substance Name: Benzoic acid, p-(butylamino)-, 2-hydroxy-3-(1-pyrrolidinyl)propyl ester, hydrochloride
RN: 100311-26-0
InChIKey: GDZLJTJTFRBSCY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H28-N2-O3.Cl-H

Molecular Weight

  • 356.891
 
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Names and Synonyms

Synonym

  • 2-Hydroxy-3-(1-pyrrolidinyl)propyl p-(butylamino)benzoate hydrochloride

Systematic Name

  • Benzoic acid, p-(butylamino)-, 2-hydroxy-3-(1-pyrrolidinyl)propyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 100311-26-0

System Generated Number

  • 0100311260

Molecular Formulas

Molecular Formula

  • C18-H28-N2-O3.Cl-H

Molecular Formula Fragments

  • C18-H28-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H28N2O3.ClH/c1-2-3-10-19-16-8-6-15(7-9-16)18(22)23-14-17(21)13-20-11-4-5-12-20;/h6-9,17,19,21H,2-5,10-14H2,1H3;1H

InChIKey

GDZLJTJTFRBSCY-UHFFFAOYSA-N

Smiles

c1(ccc(NCCCC)cc1)C(OC[C@@H](C[NH+]1CCCC1)O)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 10mg/kg (10mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 17, Pg. 1491, 1967.