Compound Identification
SMILES
O=C(COC(=O)CCC(=O)C1=CC=CC=C1)NC1=CC2=C(OCCO2)C=C1
InChIKey
InChIKey=OFTOSMAAUZKMFE-UHFFFAOYSA-N
Formula
C20H19NO6
Mass
369.373
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 Benzo-1,4-dioxanes N-arylamides Gamma-keto acids and derivatives Benzoyl derivatives Aryl alkyl ketones Fatty acid esters Alkyl aryl ethers Para dioxins Secondary carboxylic acid amides Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - Benzo-1,4-dioxane - Benzodioxane - Gamma-keto acid - Benzoyl - Aryl alkyl ketone - N-arylamide - Alkyl aryl ether - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Keto acid - Para-dioxin - Benzenoid - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Ether - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic 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