Compound Identification
SMILES
CC(OC(=O)C1=CC(Br)=C(N)C(Br)=C1)C(=O)C1=CC=CC=C1
InChIKey
InChIKey=VUJYLVIUPWIJEG-UHFFFAOYSA-N
Formula
C16H13Br2NO3
Mass
427.092
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
Benzoic acid esters Aminobenzoic acids and derivatives 3-halobenzoic acids and derivatives Phenylpropanes Benzoyl derivatives Aryl alkyl ketones 2-bromoanilines Bromobenzenes Aryl bromides Carboxylic acid esters Amino acids and derivatives Primary amines Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Aminobenzoic acid or derivatives - Benzoate ester - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Phenylpropane - Benzoyl - Aniline or substituted anilines - Aryl alkyl ketone - 2-bromoaniline - Bromobenzene - Halobenzene - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Amine - Hydrocarbon derivative - Organic oxide - Primary amine - Organic nitrogen compound - Organonitrogen compound - Organohalogen compound - Organobromide - 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