Compound Identification
SMILES
OC(=O)C(CC(=O)C1=CC=CC=C1)NC1=C(Cl)C=C(Cl)C=C1
InChIKey
InChIKey=ROXPXIRBZRKPJV-UHFFFAOYSA-N
Formula
C16H13Cl2NO3
Mass
338.18
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
Butyrophenones Alpha amino acids Phenylalkylamines Aniline and substituted anilines Aryl alkyl ketones Gamma-keto acids and derivatives Dichlorobenzenes Benzoyl derivatives Secondary alkylarylamines Aryl chlorides Beta-amino ketones Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organochlorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - Alpha-amino acid - Alpha-amino acid or derivatives - Benzoyl - Phenylalkylamine - Aniline or substituted anilines - Aryl alkyl ketone - 1,3-dichlorobenzene - Gamma-keto acid - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aryl chloride - Keto acid - Aryl halide - Monocyclic benzene moiety - Benzenoid - Beta-aminoketone - Amino acid or derivatives - Amino acid - Monocarboxylic acid or derivatives - Secondary amine - Carboxylic acid - Carboxylic acid derivative - Organonitrogen compound - Organic oxide - Amine - Organic nitrogen compound - Organochloride - Hydrocarbon derivative - 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