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Substance Name: Benzeneacetic acid, alpha-(4-(3,5-dichlorophenyl)-3-hydroxy-5-oxo-2(5H)-furanylidene)-, methyl ester
RN: 39133-76-1
InChIKey: CMZRRIONLSDQQH-ICFOKQHNSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H12-Cl2-O5

Molecular Weight

  • 391.2048
 
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Names and Synonyms

Synonyms

  • BRN 1329913
  • Methyl alpha-(4-(3,5-dichlorophenyl)-3-hydroxy-5-oxo-2(5H)-furanylidene)benzeneacetate

Systematic Name

  • Benzeneacetic acid, alpha-(4-(3,5-dichlorophenyl)-3-hydroxy-5-oxo-2(5H)-furanylidene)-, methyl ester

Registry Numbers

CAS Registry Number

  • 39133-76-1

System Generated Number

  • 0039133761

Structure Descriptors

InChI

1S/C19H12Cl2O5/c1-25-18(23)15(10-5-3-2-4-6-10)17-16(22)14(19(24)26-17)11-7-12(20)9-13(21)8-11/h2-9,22H,1H3/b17-15-

InChIKey

CMZRRIONLSDQQH-ICFOKQHNSA-N

Smiles

COC(=O)/C(=C\1/C(=C(C(=O)O1)c2cc(cc(c2)Cl)Cl)O)/c3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo oral 50mg/kg (50mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 199, 1975.