Compound Identification
SMILES
[O-]C(=O)COC1=C(C=C2C(=O)NC(=S)NC2=O)C=C(Cl)C=C1
InChIKey
InChIKey=ZMKSATNXFQTDLX-UHFFFAOYSA-M
Formula
C13H8ClN2O5S
Mass
339.73
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
Thiobarbituric acid derivatives Phenoxy compounds Phenol ethers Alkyl aryl ethers Chlorobenzenes Aryl chlorides Diazinanes Thioureas Carboxylic acid salts Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organochlorides Organic oxides Carbonyl compounds Organonitrogen compounds Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxyacetate - Thiobarbiturate - Phenoxy compound - Phenol ether - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - 1,3-diazinane - Carboxylic acid salt - Thiourea - Carboxylic acid - Organoheterocyclic compound - Azacycle - Ether - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic anion - Aromatic heteromonocyclic 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