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Substance Name: Benzoic acid, 3-(2,4-dimethylpiperidino)propyl ester, hydrochloride
RN: 67049-57-4
InChIKey: FIJGVSGCCOCZMG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H25-N-O2.Cl-H

Molecular Weight

  • 311.85
 
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Names and Synonyms

  • Benzoic acid, 3-(2,4-dimethylpiperidino)propyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 67049-57-4

System Generated Number

  • 0067049574

Molecular Formulas

Molecular Formula

  • C17-H25-N-O2.Cl-H

Molecular Formula Fragments

  • C17-H25-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H25NO2.ClH/c1-14-9-11-18(15(2)13-14)10-6-12-20-17(19)16-7-4-3-5-8-16;/h3-5,7-8,14-15H,6,9-13H2,1-2H3;1H

InChIKey

FIJGVSGCCOCZMG-UHFFFAOYSA-N

Smiles

C1[N@@H+]([C@@H](C[C@@H](C)C1)C)CCCOC(c1ccccc1)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 28mg/kg (28mg/kg)   Journal of the American Chemical Society. Vol. 68, Pg. 2592, 1946.