Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:48:13 UTC
Update Date2025-03-21 18:01:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00034267
Frequency105.1
Structure
Chemical FormulaC16H15Cl2N
Molecular Mass291.0582
SMILESCNC1CC(c2ccc(Cl)c(Cl)c2)c2ccccc21
InChI KeySVFXPTLYMIXFRX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classindanes
Subclass indanes
Direct Parent indanes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • aryl chlorides
  • dialkylamines
  • dichlorobenzenes
  • hydrocarbon derivatives
  • organochlorides
  • organopnictogen compounds
  • Substituents
  • aryl chloride
  • chlorobenzene
  • secondary aliphatic amine
  • monocyclic benzene moiety
  • organochloride
  • aromatic homopolycyclic compound
  • secondary amine
  • organohalogen compound
  • aryl halide
  • indane
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 1,2-dichlorobenzene
  • organic nitrogen compound
  • halobenzene
  • amine