Compound Identification
SMILES
COC1=CC(C=CC(=O)OCC(=O)C2=CC=C(Cl)C=C2)=CC(OC)=C1OC
InChIKey
InChIKey=OWSOJFABKWOCIL-UHFFFAOYSA-N
Formula
C20H19ClO6
Mass
390.82
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
Coumaric acids and derivatives Cinnamic acid esters Styrenes Phenoxy compounds Anisoles Methoxybenzenes Aryl alkyl ketones Benzoyl derivatives Alkyl aryl ethers Alpha-acyloxy ketones Fatty acid esters Chlorobenzenes Aryl chlorides Enoate esters Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Cinnamic acid or derivatives - Coumaric acid or derivatives - Cinnamic acid ester - Phenoxy compound - Anisole - Methoxybenzene - Benzoyl - Aryl alkyl ketone - Phenol ether - Styrene - Chlorobenzene - Alkyl aryl ether - Alpha-acyloxy ketone - Fatty acid ester - Halobenzene - Monocyclic benzene moiety - Fatty acyl - Aryl halide - Aryl chloride - Benzenoid - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Organohalogen compound - Organochloride - 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