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Substance Name: Benzeneacetic acid, alpha-(3-hydroxy-5-oxo-4-(3-(trifluoromethyl)phenyl)-2(5H)-furanylidene)-3-(trifluoromethyl)-, methyl ester, (E)-
RN: 32883-77-5
InChIKey: IJNDSTBCRMUBDX-BMRADRMJSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H12-F6-O5

Molecular Weight

  • 458.309
 
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Names and Synonyms

Synonym

  • BRN 1336075

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 32883-77-5

System Generated Number

  • 0032883775

Structure Descriptors

InChI

1S/C21H12F6O5/c1-31-18(29)15(11-5-3-7-13(9-11)21(25,26)27)17-16(28)14(19(30)32-17)10-4-2-6-12(8-10)20(22,23)24/h2-9,28H,1H3/b17-15+

InChIKey

IJNDSTBCRMUBDX-BMRADRMJSA-N

Smiles

c1(cc(ccc1)C(F)(F)F)C(\C(=O)OC)=C1\OC(C(=C1O)c1cc(ccc1)C(F)(F)F)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo oral 25mg/kg (25mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 199, 1975.