Compound Identification
SMILES
[Br-].C[N+](C)(CC(O)CNC1=CC=CC=C1Cl)CC(=O)C1=CC=C(Br)C=C1
InChIKey
InChIKey=JFAHHOIGTATKOJ-UHFFFAOYSA-M
Formula
C19H23Br2ClN2O2
Mass
506.66
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
Phenylalkylamines Aniline and substituted anilines Aryl alkyl ketones Benzoyl derivatives Secondary alkylarylamines Chlorobenzenes Bromobenzenes Aryl bromides Aryl chlorides Tetraalkylammonium salts Alpha-amino ketones Secondary alcohols 1,2-aminoalcohols Hydrocarbon derivatives Organic bromide salts Organic oxides Organic zwitterions Organobromides Organochlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Benzoyl - Phenylalkylamine - Aniline or substituted anilines - Aryl alkyl ketone - Halobenzene - Chlorobenzene - Bromobenzene - Secondary aliphatic/aromatic amine - Aryl bromide - Aryl chloride - Monocyclic benzene moiety - Benzenoid - Aryl halide - Alpha-aminoketone - Tetraalkylammonium salt - Quaternary ammonium salt - Secondary alcohol - 1,2-aminoalcohol - Secondary amine - Organic nitrogen compound - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organic zwitterion - Organic salt - Organic bromide salt - Hydrocarbon derivative - Amine - Organic oxide - Alcohol - 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