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Substance Name: Cinnamic acid, p-chloro-alpha-(p-methoxyphenyl)-, 3-tropanyl ester, hydrochloride
RN: 67210-47-3
InChIKey: LICYFKWVZVSLBN-PUZWSPMBSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H26-Cl-N-O3.Cl-H

Molecular Weight

  • 448.387
 
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Names and Synonyms

Synonym

  • p-Chloro-alpha-(p-methoxyphenyl)cinnamic acid 3-tropanyl ester hydrochloride

Systematic Name

  • Cinnamic acid, p-chloro-alpha-(p-methoxyphenyl)-, 3-tropanyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 67210-47-3

System Generated Number

  • 0067210473

Molecular Formulas

Molecular Formula

  • C24-H26-Cl-N-O3.Cl-H

Molecular Formula Fragments

  • C24-H26-Cl-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C24H26ClNO3.ClH/c1-26-19-9-10-20(26)15-22(14-19)29-24(27)23(13-16-3-7-18(25)8-4-16)17-5-11-21(28-2)12-6-17;/h3-8,11-13,19-20,22H,9-10,14-15H2,1-2H3;1H/b23-13+;

InChIKey

LICYFKWVZVSLBN-PUZWSPMBSA-N

Smiles

C(\c1ccc(OC)cc1)(=C/c1ccc(Cl)cc1)C(OC1C[C@@H]2[NH+](C)[C@@H](C1)CC2)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 384mg/kg (384mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 1076, 1970.