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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:59 UTC
Update Date2025-03-25 00:49:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02171539
Frequency0.5
Structure
Chemical FormulaC11H12Cl2N2
Molecular Mass242.0378
SMILESCN(C)Cc1c[nH]c2cc(Cl)c(Cl)cc12
InChI KeyUOSKXEVWJSTQAG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aralkylamines
  • aryl chlorides
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organochlorides
  • organopnictogen compounds
  • pyrroles
  • trialkylamines
  • Substituents
  • aryl chloride
  • azacycle
  • indole
  • organochloride
  • heteroaromatic compound
  • tertiary aliphatic amine
  • organohalogen compound
  • aralkylamine
  • aryl halide
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • tertiary amine