Compound Identification
SMILES
CCC1=C(Br)C(=CC(C(C)=O)=C1O)C#N
InChIKey
InChIKey=GYDIFJFZUAJTNX-UHFFFAOYSA-N
Formula
C11H10BrNO2
Mass
268.11
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
Acetophenones M-bromophenols Benzoyl derivatives Benzonitriles Aryl alkyl ketones Bromobenzenes Aryl bromides Vinylogous acids Nitriles Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Acetophenone - Benzonitrile - Benzoyl - 3-halophenol - 3-bromophenol - Aryl alkyl ketone - Bromobenzene - Phenol - Halobenzene - Monocyclic benzene moiety - Benzenoid - Aryl bromide - Aryl halide - Vinylogous acid - Carbonitrile - Nitrile - Hydrocarbon derivative - Organonitrogen compound - Cyanide - Organic nitrogen compound - Organic oxide - 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