Compound Identification
SMILES
ClC1=C(Cl)C=C(C=C1)C(=O)COC(=O)CC(Br)C1=CC=CC=C1
InChIKey
InChIKey=YLPDBVGDABXCKO-UHFFFAOYSA-N
Formula
C17H13BrCl2O3
Mass
416.09
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
Dichlorobenzenes Benzoyl derivatives Aryl alkyl ketones Fatty acid esters Alpha-acyloxy ketones Aryl chlorides Carboxylic acid esters Monocarboxylic acids and derivatives Organochlorides Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Benzoyl - 1,2-dichlorobenzene - Aryl alkyl ketone - Alpha-acyloxy ketone - Halobenzene - Fatty acid ester - Chlorobenzene - Fatty acyl - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxide - Alkyl halide - Alkyl bromide - Organohalogen compound - Organobromide - Organochloride - Hydrocarbon derivative - 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