Compound Identification
SMILES
[Na+].[O-]S(=O)(=O)CCN\C=C1/C=CC=C(CC=C)C1=O
InChIKey
InChIKey=UUHZJBVXTKFLHU-LBEJWNQZSA-M
Formula
C12H14NNaO4S
Mass
291.3
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 O-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
O-quinomethanes
Alternative Parents
Vinylogous amides Sulfonyls Organosulfonic acids Alkanesulfonic acids Enamines Dialkylamines Allylamines Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
O-quinomethane - Organic sulfonic acid or derivatives - Vinylogous amide - Organosulfonic acid or derivatives - Organosulfonic acid - Alkanesulfonic acid - Sulfonyl - Secondary aliphatic amine - Enamine - Allylamine - Organic alkali metal salt - Amine - Organic nitrogen compound - Organic salt - Organic sodium salt - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic cation - Aliphatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.
External Descriptors
Not available