Compound Identification
SMILES
CCOC(=O)C(\OCC(O)=O)=C(\C)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=ZLNIFZMUAKUGBN-UKTHLTGXSA-N
Formula
C14H15ClO5
Mass
298.72
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylpyruvic acid derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyruvic acid derivatives
Alternative Parents
Cinnamic acid esters Phenylpropenes Fatty acid esters Chlorobenzenes Dicarboxylic acids and derivatives Aryl chlorides Enoate esters Carboxylic acids Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamic acid ester - Enol-phenylpyruvate - Cinnamic acid or derivatives - Phenylpropene - Chlorobenzene - Halobenzene - Fatty acid ester - Aryl chloride - Aryl halide - Fatty acyl - Dicarboxylic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Carboxylic acid derivative - Carboxylic acid - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyruvic acid derivatives. These are compounds containing a phenylpyruvic acid moiety, which consists of a phenyl group substituted at the second position by an pyruvic acid.
External Descriptors
Not available