Compound Identification
SMILES
OC(=O)CCCC(=O)C1=CC(CC=C)=C(OCCCCC#N)C=C1O
InChIKey
InChIKey=TYRGAZOWWIDGKB-UHFFFAOYSA-N
Formula
C19H23NO5
Mass
345.395
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
Butyrophenones Aryl alkyl ketones Phenoxy compounds Phenol ethers Benzoyl derivatives Medium-chain fatty acids 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Amino fatty acids Hydroxy fatty acids Vinylogous acids Nitriles Carboxylic acids Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - Phenoxy compound - Benzoyl - Aryl alkyl ketone - Medium-chain fatty acid - Phenol ether - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Amino fatty acid - Phenol - Hydroxy fatty acid - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Vinylogous acid - Carboxylic acid derivative - Carboxylic acid - Ether - Nitrile - Monocarboxylic acid or derivatives - Carbonitrile - Organic nitrogen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - 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