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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:16 UTC
Update Date2025-03-25 00:50:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02181415
Frequency0.5
Structure
Chemical FormulaC15H11Cl2NO2
Molecular Mass307.0167
SMILESOC1=NC(c2ccc(Cl)cc2)(c2ccc(Cl)cc2)OC1
InChI KeyBQYLEMMJEIITJL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylmethanes
Direct Parent diphenylmethanes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aryl chlorides
  • azacyclic compounds
  • chlorobenzenes
  • cyclic carboximidic acids
  • hydrocarbon derivatives
  • organochlorides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxazolines
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aryl chloride
  • chlorobenzene
  • diphenylmethane
  • aromatic heteromonocyclic compound
  • azacycle
  • organochloride
  • organic 1,3-dipolar compound
  • organohalogen compound
  • aryl halide
  • propargyl-type 1,3-dipolar organic compound
  • oxacycle
  • oxazoline
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • halobenzene
  • cyclic carboximidic acid
  • organoheterocyclic compound
  • organooxygen compound