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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:46 UTC
Update Date2025-03-25 00:46:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02152940
Frequency0.5
Structure
Chemical FormulaC8H7Cl2NO2
Molecular Mass218.9854
SMILESNC(=O)Cc1ccc(O)c(Cl)c1Cl
InChI KeyZSJWFSUNTICVPU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylacetamides
Direct Parent phenylacetamides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • aryl chlorides
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dichlorobenzenes
  • halophenols
  • hydrocarbon derivatives
  • m-chlorophenols
  • o-chlorophenols
  • organic oxides
  • organochlorides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • organochloride
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • organohalogen compound
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • 1,2-dichlorobenzene
  • phenylacetamide
  • aryl chloride
  • 2-chlorophenol
  • chlorobenzene
  • 3-halophenol
  • 3-chlorophenol
  • carboxamide group
  • aryl halide
  • aromatic homomonocyclic compound
  • 2-halophenol
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • organic nitrogen compound
  • halobenzene
  • organooxygen compound