Compound Identification
SMILES
CCSC1=C(N2CC2)C(=O)[C@]2(Cl)[C@H]3C[C@H](C=C3)[C@]2(Cl)C1=O
InChIKey
InChIKey=PDTUSQQUWNEGEN-PPZCWDAYSA-N
Formula
C15H15Cl2NO2S
Mass
344.25
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Cyclic ketones
- Level 7 Cyclohexenones
-
Level 6
Cyclic ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Cyclic ketones
Direct Parent
Cyclohexenones
Alternative Parents
Vinylogous thioesters Vinylogous amides N-vinylaziridines Alpha-chloroketones Trialkylamines Thioenol ethers Sulfenyl compounds Enamines Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Cyclohexenone - Vinylogous thioester - Alpha-haloketone - Alpha-chloroketone - Vinylogous amide - N-vinylaziridine - Vinylaziridine - Tertiary amine - Thioenolether - Tertiary aliphatic amine - Aziridine - Enamine - Sulfenyl compound - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organosulfur compound - Organonitrogen compound - Organochloride - Organohalogen compound - Alkyl chloride - Organic oxide - Hydrocarbon derivative - Alkyl halide - Amine - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cyclohexenones. These are compounds containing a cylohexenone moiety, which is a six-membered aliphatic ring that carries a ketone and has one endocyclic double bond.
External Descriptors
Not available