Compound Identification
SMILES
COC(=O)C(=O)C=C([O-])C1=C(Cl)C=C(Cl)C=C1
InChIKey
InChIKey=RVXIOVGKJNNFKI-UHFFFAOYSA-M
Formula
C11H7Cl2O4
Mass
274.07
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 Dichlorobenzenes Fatty acid esters Aryl chlorides Alpha-keto acids and derivatives Vinylogous acids Methyl esters Enones Acryloyl compounds Ketones Monocarboxylic acids and derivatives Organochlorides Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamic acid or derivatives - 1,3-dichlorobenzene - Styrene - Chlorobenzene - Fatty acid ester - Halobenzene - Alpha-keto acid - Aryl chloride - Aryl halide - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Keto acid - Acryloyl-group - Vinylogous acid - Alpha,beta-unsaturated ketone - Methyl ester - Enone - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organochloride - Organohalogen compound - Organic anion - 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