Compound Identification
SMILES
[Br-].BrC1=CC=C(C=C1)C(=O)C[N+]12CCC(CC1)C(=O)C2
InChIKey
InChIKey=ZRNGUQHYMQWGQV-UHFFFAOYSA-M
Formula
C15H17Br2NO2
Mass
403.114
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
Quinuclidones Benzoyl derivatives Aryl alkyl ketones Piperidinones Bromobenzenes Aryl bromides Tetraalkylammonium salts Alpha-amino ketones Azacyclic compounds Organobromides Organic oxides Organic bromide salts Hydrocarbon derivatives Amines Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Quinuclidone - Benzoyl - Aryl alkyl ketone - Quinuclidine - Bromobenzene - Halobenzene - Piperidinone - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Piperidine - Benzenoid - Alpha-aminoketone - Tetraalkylammonium salt - Quaternary ammonium salt - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organobromide - Organohalogen compound - Organic bromide salt - Hydrocarbon derivative - Amine - Organic oxide - Organic nitrogen compound - Organic salt - Organic cation - 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