Compound Identification
SMILES
COC1=C(OCC2=CC=C(C)C=C2)C(Cl)=CC(=C1)C(=O)OCC(=O)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=SMRFWPDTUKNRGK-UHFFFAOYSA-N
Formula
C24H20Cl2O5
Mass
459.32
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
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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
M-methoxybenzoic acids and derivatives 3-halobenzoic acids and derivatives Benzoic acid esters Phenoxy compounds Methoxybenzenes Anisoles Aryl alkyl ketones Benzoyl derivatives Toluenes Alkyl aryl ethers Chlorobenzenes Aryl chlorides Carboxylic acid esters Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - M-methoxybenzoic acid or derivatives - Benzoate ester - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Aryl alkyl ketone - Methoxybenzene - Anisole - Phenol ether - Benzoyl - Phenoxy compound - Toluene - Alkyl aryl ether - Halobenzene - Chlorobenzene - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Carboxylic acid ester - Carboxylic acid derivative - Ether - Organochloride - Hydrocarbon derivative - Organic oxide - Organohalogen compound - 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