Compound Identification
SMILES
CC(=O)NC1=C(Cl)C=CC(C(=O)C2C(=O)CCC(C)(C)C2=O)=C1Cl
InChIKey
InChIKey=GXHJTWHIGUSMDX-UHFFFAOYSA-N
Formula
C17H17Cl2NO4
Mass
370.23
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
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Subclass
Carbonyl compounds
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Level 5
Ketones
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Level 6
Aryl ketones
-
Level 7
Phenylketones
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Level 8
Alkyl-phenylketones
- Level 9 Benzoylcyclohexane-1,3-diones
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Level 8
Alkyl-phenylketones
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Level 7
Phenylketones
-
Level 6
Aryl ketones
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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 - Alkyl-phenylketones
Direct Parent
Benzoylcyclohexane-1,3-diones
Alternative Parents
O-haloacetanilides Aromatic monoterpenoids Monocyclic monoterpenoids N-acetylarylamines Aryl alkyl ketones Dichlorobenzenes Benzoyl derivatives Beta-diketones Aryl chlorides Vinylogous halides Acetamides Secondary carboxylic acid amides Cyclic ketones Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzoylcyclohexane-1,3-dione - O-haloacetanilide - Haloacetanilide - Acetanilide - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - N-acetylarylamine - Anilide - 1,3-dichlorobenzene - Benzoyl - N-arylamide - Aryl alkyl ketone - 1,3-diketone - Chlorobenzene - Halobenzene - Aryl halide - 1,3-dicarbonyl compound - Monocyclic benzene moiety - Aryl chloride - Benzenoid - Vinylogous halide - Acetamide - Cyclic ketone - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Organic oxide - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoylcyclohexane-1,3-diones. These are alkyl-phenylketones where the alkyl group is a cyclohexane 1,3-dione.
External Descriptors
Not available