Compound Identification
SMILES
NC(C(O)=O)C(=O)C1=CC=CC=C1
InChIKey
InChIKey=FFSGLKWXIJLRST-UHFFFAOYSA-N
Formula
C9H9NO3
Mass
179.175
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
Phenylpropanoic acids Alpha amino acids Benzoyl derivatives Aryl alkyl ketones Beta-keto acids and derivatives Beta-hydroxy ketones 1,3-dicarbonyl compounds Alpha-amino ketones Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - 3-phenylpropanoic-acid - Alpha-amino acid - Alpha-amino acid or derivatives - Benzoyl - Aryl alkyl ketone - Beta-keto acid - Monocyclic benzene moiety - Beta-hydroxy ketone - Keto acid - 1,3-dicarbonyl compound - Benzenoid - Alpha-aminoketone - Amino acid - Amino acid or derivatives - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Primary aliphatic amine - Organopnictogen compound - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Primary amine - Amine - 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