Compound Identification
SMILES
CCC(=C)C(=O)C1=C(Cl)C=C(OCC(O)=O)C=C1
InChIKey
InChIKey=LDYTZOXEYBFSEN-UHFFFAOYSA-N
Formula
C13H13ClO4
Mass
268.69
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenoxyacetic acid derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Phenoxyacetic acid derivatives
Alternative Parents
Butyrophenones Aryl ketones Phenoxy compounds Phenol ethers Benzoyl derivatives Alkyl aryl ethers Chlorobenzenes Aryl chlorides Alpha-branched alpha,beta-unsaturated ketones Enones Acryloyl compounds Vinylogous halides Carboxylic acids Monocarboxylic acids and derivatives Organic oxides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenoxyacetate - Butyrophenone - Phenoxy compound - Aryl ketone - Phenol ether - Benzoyl - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Alpha-branched alpha,beta-unsaturated-ketone - Aryl halide - Acryloyl-group - Vinylogous halide - Alpha,beta-unsaturated ketone - Enone - Ketone - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Ether - Organic oxygen compound - Carbonyl group - Organohalogen compound - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenoxyacetic acid derivatives. These are compounds containing an anisole where the methane group is linked to an acetic acid or a derivative.
External Descriptors
Not available