Compound Identification
SMILES
BrC1=CC=C(C=C1)C(=O)C[N+]12CCC(CC1)C(=O)C2
InChIKey
InChIKey=TULYQLKMVUAGSQ-UHFFFAOYSA-N
Formula
C15H17BrNO2
Mass
323.209
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
-
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 Hydrocarbon derivatives Amines Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Quinuclidone - Benzoyl - Quinuclidine - Aryl alkyl ketone - Piperidinone - Bromobenzene - Halobenzene - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Piperidine - Tetraalkylammonium salt - Quaternary ammonium salt - Alpha-aminoketone - Azacycle - Organoheterocyclic compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organonitrogen compound - Amine - Organic nitrogen compound - 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