Compound Identification
SMILES
CCOC(=O)C1=CC(C(=O)OCC)=C(C=C1)C(=O)CCCCl
InChIKey
InChIKey=HHLBCTPVFYNJQV-UHFFFAOYSA-N
Formula
C16H19ClO5
Mass
326.77
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
m-Phthalate esters M-phthalic acid and derivatives Butyrophenones Benzoic acid esters Benzoyl derivatives Aryl alkyl ketones Carboxylic acid esters Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Meta-phthalic acid ester - Alkyl-phenylketone - Phthalate ester - Meta_phthalic_acid - Butyrophenone - Benzoate ester - Benzoic acid or derivatives - Aryl alkyl ketone - Benzoyl - Benzenoid - Monocyclic benzene moiety - Carboxylic acid ester - Carboxylic acid derivative - Organic oxide - Organochloride - Organohalogen compound - Alkyl chloride - Alkyl halide - 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