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Substance Name: 2-Propanone, 1-(3-(trifluoromethyl)phenyl)-, O-(3,4,5-trimethoxybenzoyl)oxime
RN: 38059-99-3
InChIKey: IJJWZPPQNCLSQQ-WYMPLXKRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H20-F3-N-O5

Molecular Weight

  • 411.374
 
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Names and Synonyms

Synonyms

  • (Trimethoxy-3,4,5-benzoyl)oxyimino m-(trifluoromethyl)benzylmethylcetone
  • (Trimethoxy-3,4,5-benzoyl)oxyimino m-(trifluoromethyl)benzylmethylcetone [French]
  • 1-(3-(Trifluoromethyl)phenyl)-2-propanone O-(3,4,5-trimethoxybenzoyl)oxime
  • BRN 2186613

Systematic Name

  • 2-Propanone, 1-(3-(trifluoromethyl)phenyl)-, O-(3,4,5-trimethoxybenzoyl)oxime

Registry Numbers

CAS Registry Number

  • 38059-99-3

System Generated Number

  • 0038059993

Structure Descriptors

InChI

1S/C20H20F3NO5/c1-12(8-13-6-5-7-15(9-13)20(21,22)23)24-29-19(25)14-10-16(26-2)18(28-4)17(11-14)27-3/h5-7,9-11H,8H2,1-4H3/b24-12+

InChIKey

IJJWZPPQNCLSQQ-WYMPLXKRSA-N

Smiles

C/C(=N\OC(=O)c1cc(c(c(c1)OC)OC)OC)/Cc2cccc(c2)C(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 2gm/kg (2000mg/kg)   Chimica Therapeutica. Vol. 7, Pg. 140, 1972.