Compound Identification
SMILES
COC1=C(OCC(C)C)C=CC(=C1)C(=O)OCC(=O)NC1=CC=C(C=C1)C(C)=O
InChIKey
InChIKey=CAHXDGYVOCZPCG-UHFFFAOYSA-N
Formula
C22H25NO6
Mass
399.443
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
M-methoxybenzoic acids and derivatives Benzoic acid esters Anilides Acetophenones Phenoxy compounds N-arylamides Methoxybenzenes Benzoyl derivatives Aryl alkyl ketones Anisoles Alkyl aryl ethers Secondary carboxylic acid amides Carboxylic acid esters Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - M-methoxybenzoic acid or derivatives - Benzoate ester - Acetophenone - Benzoic acid or derivatives - Anilide - Anisole - Aryl alkyl ketone - N-arylamide - Methoxybenzene - Phenol ether - Phenoxy compound - Benzoyl - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - 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