Compound Identification
SMILES
CC1=C(C=CC2=C1OCCS2(=O)=O)C(=O)C1C(=O)CCCC1=O
InChIKey
InChIKey=KUJMWJZJRKJCMU-UHFFFAOYSA-N
Formula
C16H16O6S
Mass
336.36
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
- Level 7 Aryl alkyl ketones
-
Level 6
Aryl 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 - Aryl ketones
Direct Parent
Aryl alkyl ketones
Alternative Parents
Beta-diketones Alkyl aryl ethers Oxathiins Benzoxathiins Benzenoids Sulfones Cyclic ketones Oxacyclic compounds Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aryl alkyl ketone - Alkyl aryl ether - 1,3-diketone - 1,4-benzooxathiin - 1,4-oxathiin - Benzenoid - 1,3-dicarbonyl compound - Sulfone - Cyclic ketone - Organoheterocyclic compound - Oxacycle - Ether - Hydrocarbon derivative - Organic oxide - Aldehyde - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl group.
External Descriptors
Not available