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Substance Name: Benzoic acid, p-amino-, 3-(N-benzyl-N-methylamino)propyl ester, hydrochloride
RN: 69781-70-0
InChIKey: BOMAHWOUBQICSQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H22-N2-O2.Cl-H

Molecular Weight

  • 334.845
 
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Names and Synonyms

Synonym

  • p-Aminobenzoic acid 3-(N-benzyl-N-methylamino)propyl ester hydrochloride

Systematic Name

  • Benzoic acid, p-amino-, 3-(N-benzyl-N-methylamino)propyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 69781-70-0

System Generated Number

  • 0069781700

Molecular Formulas

Molecular Formula

  • C18-H22-N2-O2.Cl-H

Molecular Formula Fragments

  • C18-H22-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H22N2O2.ClH/c1-20(14-15-6-3-2-4-7-15)12-5-13-22-18(21)16-8-10-17(19)11-9-16;/h2-4,6-11H,5,12-14,19H2,1H3;1H

InChIKey

BOMAHWOUBQICSQ-UHFFFAOYSA-N

Smiles

c1(ccc(N)cc1)C(OCCC[N@@H+](Cc1ccccc1)C)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo subcutaneous 150mg/kg (150mg/kg)   Journal of the American Chemical Society. Vol. 53, Pg. 1587, 1931.
rat LDLo intravenous 30mg/kg (30mg/kg)   Journal of the American Chemical Society. Vol. 53, Pg. 1587, 1931.