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Substance Name: Nipecotic acid, 1-methyl-4-phenyl-, propyl ester, hydrobromide, (Z)-(+-)-
RN: 57153-01-2
InChIKey: XIPOFIKFJDIYEZ-CTHHTMFSSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H23-N-O2.Br-H

Molecular Weight

  • 342.275
 
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Names and Synonyms

Synonym

  • (+-)-1-Methyl-4-phenylnipecotic acid propyl ester hydrobromide

Systematic Name

  • Nipecotic acid, 1-methyl-4-phenyl-, propyl ester, hydrobromide, (Z)-(+-)-

Registry Numbers

CAS Registry Number

  • 57153-01-2

System Generated Number

  • 0057153012

Molecular Formulas

Molecular Formula

  • C16-H23-N-O2.Br-H

Molecular Formula Fragments

  • Br-H
  • C16-H23-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C16H23NO2.BrH/c1-3-11-19-16(18)15-12-17(2)10-9-14(15)13-7-5-4-6-8-13;/h4-8,14-15H,3,9-12H2,1-2H3;1H/t14-,15-;/m1./s1

InChIKey

XIPOFIKFJDIYEZ-CTHHTMFSSA-N

Smiles

c1([C@@H]2[C@@H](C[N@@H+](C)CC2)C(OCCC)=O)ccccc1.[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 125mg/kg (125mg/kg)   Archiv der Pharmazie Vol. 308, Pg. 676, 1975.