Compound Identification
SMILES
ON([O-])C1=CC=CC(=C1)C(=O)CC1(O)C(=O)NC2=C1C=C(Br)C=C2
InChIKey
InChIKey=XYZXGBUAMQMXIG-UHFFFAOYSA-N
Formula
C16H12BrN2O5
Mass
392.186
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
Indolines Benzoyl derivatives Aryl alkyl ketones Beta-hydroxy ketones Aryl bromides Tertiary alcohols Secondary carboxylic acid amides Lactams N-organohydroxylamines Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Indole or derivatives - Dihydroindole - Benzoyl - Aryl alkyl ketone - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Beta-hydroxy ketone - Benzenoid - Tertiary alcohol - Secondary carboxylic acid amide - Lactam - Carboxamide group - N-organohydroxylamine - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Organobromide - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Alcohol - Organohalogen compound - Organic anion - Aromatic heteropolycyclic 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