Compound Identification
SMILES
CCOC(=O)C(=O)CC(=O)C=CC1=CC=C(Cl)C=C1
InChIKey
InChIKey=RZOKOCSANAWZCH-UHFFFAOYSA-N
Formula
C14H13ClO4
Mass
280.7
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acids and derivatives
Alternative Parents
Styrenes 3-Acylpyruvic acids Fatty acid esters Chlorobenzenes Beta-diketones Aryl chlorides Alpha-keto acids and derivatives Enones Acryloyl compounds Ketones Carboxylic acid esters Monocarboxylic acids and derivatives Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamic acid or derivatives - 3-acylpyruvic acid - Gamma-keto acid - Styrene - Chlorobenzene - Fatty acid ester - 1,3-diketone - Halobenzene - Alpha-keto acid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Keto acid - Benzenoid - 1,3-dicarbonyl compound - Alpha,beta-unsaturated ketone - Enone - Acryloyl-group - Carboxylic acid ester - Ketone - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organochloride - Organooxygen compound - Carbonyl group - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acids and derivatives. These are organic aromatic compounds containing a benzene and a carboxylic acid group (or a derivative thereof) forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available