Compound Identification
SMILES
CCOC(=O)C(=O)C(Cl)C(=O)C1=CC2=CC=CC=C2C=C1
InChIKey
InChIKey=FRVIEKWRMOKRJT-UHFFFAOYSA-N
Formula
C16H13ClO4
Mass
304.73
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Butyrophenones
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Butyrophenones
Intermediate Tree Nodes
Not available
Direct Parent
Butyrophenones
Alternative Parents
Naphthalenes Gamma-keto acids and derivatives Aryl alkyl ketones Fatty acid esters Beta-diketones Alpha-keto acids and derivatives Alpha-chloroketones Carboxylic acid esters Monocarboxylic acids and derivatives Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Butyrophenone - Naphthalene - Gamma-keto acid - Aryl ketone - Aryl alkyl ketone - 1,3-diketone - Fatty acid ester - Fatty acyl - Alpha-keto acid - 1,3-dicarbonyl compound - Keto acid - Alpha-haloketone - Alpha-chloroketone - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxygen compound - Alkyl chloride - Organohalogen compound - Organochloride - Organooxygen compound - Carbonyl group - Alkyl halide - Hydrocarbon derivative - Organic oxide - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as butyrophenones. These are compounds containing 1-phenylbutan-1-one moiety.
External Descriptors
Not available