Compound Identification
SMILES
CC1(C)CN\C(S1)=C1/C=CC(=O)C=C1O
InChIKey
InChIKey=CYLJICZFCALYQH-NTMALXAHSA-N
Formula
C11H13NO2S
Mass
223.29
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
Quinomethanes
- Level 8 P-quinomethanes
-
Level 7
Quinomethanes
-
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 - Quinomethanes
Direct Parent
P-quinomethanes
Alternative Parents
Vinylogous acids Thiazolidines Ketene acetals Enols Dialkylamines Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
P-quinomethane - Thiazolidine - Vinylogous acid - Ketene acetal or derivatives - Azacycle - Organoheterocyclic compound - Secondary amine - Enol - Secondary aliphatic amine - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as p-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 4, respectively.
External Descriptors
Not available