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Record Information
HMDB Statusdetected
Creation Date2024-02-20 23:36:40 UTC
Update Date2025-03-21 17:57:24 UTC
HMDB IDHMDB0250125
Metabolite Identification
DeepMet IDDMID00007668
NameChlorothalonil
Frequency652.2
Structure
Chemical FormulaC8Cl4N2
Molecular Mass263.8816
SMILESN#Cc1c(Cl)c(Cl)c(Cl)c(C#N)c1Cl
InChI KeyCRQQGFGUEAVUIL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzonitriles
Direct Parent benzonitriles
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aryl chlorides
  • chlorobenzenes
  • hydrocarbon derivatives
  • nitriles
  • organochlorides
  • organonitrogen compounds
  • organopnictogen compounds
    • Substituents
  • aryl chloride
  • chlorobenzene
  • nitrile
  • organochloride
  • organohalogen compound
  • benzonitrile
  • aryl halide
  • aromatic homomonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • halobenzene
  • carbonitrile