Compound Identification
SMILES
[Na+].CC1=C(OCC([O-])=O)C=CC(Cl)=C1.CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O
InChIKey
InChIKey=JTXAFVFKDIAJSO-UHFFFAOYSA-M
Formula
C19H20ClN2NaO6S
Mass
462.88
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
Phenoxy compounds Phenol ethers Toluenes Alkyl aryl ethers Chlorobenzenes Aryl chlorides Vinylogous amides Organic sulfuric acids and derivatives Carboxylic acid salts Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organic metal halides Organic oxides Organochlorides Organic sodium salts Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organic cations
Molecular Framework
Not available
Substituents
Phenoxyacetate - Phenoxy compound - Phenol ether - Alkyl aryl ether - Halobenzene - Toluene - Chlorobenzene - Aryl chloride - Aryl halide - Vinylogous amide - Organic sulfuric acid or derivatives - Carboxylic acid salt - Organoheterocyclic compound - Carboxylic acid - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic metal halide - Ether - Organic alkali metal salt - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic salt - Organic sodium salt - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic cation - Aromatic heteropolycyclic 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