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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:49 UTC
Update Date2025-03-25 00:47:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02162006
Frequency0.5
Structure
Chemical FormulaC12H13Cl2NO4S
Molecular Mass336.9942
SMILESO=C(O)C1CCN(S(=O)(=O)c2cccc(Cl)c2Cl)CC1
InChI KeySFTOWIQDHOZZCG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzenesulfonamides
Direct Parent benzenesulfonamides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aryl chlorides
  • azacyclic compounds
  • benzenesulfonyl compounds
  • carbonyl compounds
  • carboxylic acids
  • dichlorobenzenes
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organochlorides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfonamides
  • piperidinecarboxylic acids
  • piperidines
  • sulfonyls
    • Substituents
  • organosulfonic acid or derivatives
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • organochloride
  • organosulfur compound
  • carboxylic acid derivative
  • organohalogen compound
  • organosulfonic acid amide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • piperidinecarboxylic acid
  • 1,2-dichlorobenzene
  • piperidine
  • organoheterocyclic compound
  • benzenesulfonyl group
  • aryl chloride
  • chlorobenzene
  • benzenesulfonamide
  • azacycle
  • aryl halide
  • monocarboxylic acid or derivatives
  • sulfonyl
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • halobenzene
  • organooxygen compound