Compound Identification
SMILES
CCC1=C(O)C=C(O)C(=C1)C(=O)COC1=CC=C(I)C=C1
InChIKey
InChIKey=KLCKIIGWTHQDHG-UHFFFAOYSA-N
Formula
C16H15IO4
Mass
398.196
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
Phenylketones
- Level 8 Alkyl-phenylketones
-
Level 7
Phenylketones
-
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 - Phenylketones
Direct Parent
Alkyl-phenylketones
Alternative Parents
Resorcinols Phenoxy compounds Phenol ethers Benzoyl derivatives Aryl alkyl ketones Iodobenzenes Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Aryl iodides Vinylogous acids Organoiodides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Benzoyl - Phenol ether - Resorcinol - Aryl alkyl ketone - Phenoxy compound - Phenol - Iodobenzene - Halobenzene - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Aryl iodide - Benzenoid - Aryl halide - Monocyclic benzene moiety - Vinylogous acid - Ether - Organoiodide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available