Compound Identification
SMILES
NC(CC(O)=O)C(=O)C1=CC=CC=C1
InChIKey
InChIKey=JBYDNDPLLIMTCN-UHFFFAOYSA-N
Formula
C10H11NO3
Mass
193.202
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
Butyrophenones Beta amino acids and derivatives Gamma-keto acids and derivatives Benzoyl derivatives Aryl alkyl ketones Amino fatty acids Alpha-amino ketones Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Beta amino acid or derivatives - Butyrophenone - Benzoyl - Gamma-keto acid - Aryl alkyl ketone - Amino fatty acid - Benzenoid - Fatty acyl - Keto acid - Monocyclic benzene moiety - Alpha-aminoketone - Amino acid or derivatives - Amino acid - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Primary amine - Organic nitrogen compound - Organic oxide - Amine - Primary aliphatic amine - Organonitrogen compound - Hydrocarbon derivative - 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