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Substance Name: Benzoic acid, p-amino-, 3-(di-2-butylamino)propyl ester, hydrochloride
RN: 15154-33-3
InChIKey: QTIKCYSVXGJFQC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H30-N2-O2.Cl-H

Molecular Weight

  • 342.908
 
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Names and Synonyms

Synonyms

  • NSC 159413
  • p-Aminobenzoic acid 3-(di-2-butyl)aminopropyl ester hydrochloride

Systematic Names

  • 1-Propanol, 3-(bis(1-methylpropyl)amino)-, 4-aminobenzoate (ester), monohydrochloride (9CI)
  • Benzoic acid, p-amino-, 3-(di-2-butylamino)propyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 15154-33-3

System Generated Number

  • 0015154333

Molecular Formulas

Molecular Formula

  • C18-H30-N2-O2.Cl-H

Molecular Formula Fragments

  • C18-H30-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H30N2O2.ClH/c1-5-14(3)20(15(4)6-2)12-7-13-22-18(21)16-8-10-17(19)11-9-16;/h8-11,14-15H,5-7,12-13,19H2,1-4H3;1H

InChIKey

QTIKCYSVXGJFQC-UHFFFAOYSA-N

Smiles

[NH+](CCCOC(c1ccc(N)cc1)=O)([C@@H](CC)C)[C@@H](CC)C.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 unreported 75mg/kg (75mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 17, Pg. 1012, 1967.