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Substance Name: Benzoic acid, p-(propylamino)-, 2-hydroxy-3-piperidinopropyl ester, hydrochloride
RN: 100482-39-1
InChIKey: SBINTGJTDIGHIS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H28-N2-O3.Cl-H

Molecular Weight

  • 372.934
 
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Names and Synonyms

Synonym

  • 2-Hydroxy-3-piperidinopropyl p-(propylamino)benzoate hydrochloride

Systematic Name

  • Benzoic acid, p-(propylamino)-, 2-hydroxy-3-piperidinopropyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 100482-39-1

System Generated Number

  • 0100482391

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.CH4.ClH/c1-2-10-19-16-8-6-15(7-9-16)18(22)23-14-17(21)13-20-11-4-3-5-12-20;;/h6-9,17,19,21H,2-5,10-14H2,1H3;1H4;1H

InChIKey

SBINTGJTDIGHIS-UHFFFAOYSA-N

Smiles

c1(ccc(NCCC)cc1)C(OC[C@@H](C[NH+]1CCCCC1)O)=O.C.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 4mg/kg (4mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 17, Pg. 1491, 1967.