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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:53:32 UTC
Update Date2025-03-21 18:03:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00047060
Frequency70.9
Structure
Chemical FormulaC14H11Cl2NO2
Molecular Mass295.0167
SMILESCC(=O)Nc1ccc(Oc2ccc(Cl)cc2Cl)cc1
InChI KeyDKGLREXAQONRLO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylethers
Direct Parent diphenylethers
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • acetamides
  • acetanilides
  • aryl chlorides
  • carbonyl compounds
  • carboxylic acids and derivatives
  • diarylethers
  • dichlorobenzenes
  • hydrocarbon derivatives
  • n-acetylarylamines
  • organic oxides
  • organochlorides
  • organopnictogen compounds
  • phenol ethers
  • phenoxy compounds
  • secondary carboxylic acid amides
  • Substituents
  • diaryl ether
  • phenol ether
  • carbonyl group
  • ether
  • n-acetylarylamine
  • organochloride
  • n-arylamide
  • carboxylic acid derivative
  • organohalogen compound
  • 1,3-dichlorobenzene
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • acetamide
  • aryl chloride
  • chlorobenzene
  • acetanilide
  • carboxamide group
  • aryl halide
  • aromatic homomonocyclic compound
  • anilide
  • secondary carboxylic acid amide
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • halobenzene
  • phenoxy compound
  • diphenylether
  • organooxygen compound