Compound Identification
SMILES
CCOC(=O)C1=C(NC2=CC=C(OCC)C=C2)S\C(=C/C2=CC(OC)=C(OCC([O-])=O)C=C2)C1=O
InChIKey
InChIKey=MOFZYTWOPPTCMO-MOSHPQCFSA-M
Formula
C25H24NO8S
Mass
498.53
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 Aniline and substituted anilines Anisoles Methoxybenzenes Alkyl aryl ethers Vinylogous thioesters Dicarboxylic acids and derivatives Vinylogous amides Dihydrothiophenes Enoate esters Thioenol ethers Carboxylic acid salts Cyclic ketones Ketene acetals Carboxylic acids Amines Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxyacetate - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Aniline or substituted anilines - Alkyl aryl ether - Vinylogous thioester - Dicarboxylic acid or derivatives - 2,3-dihydrothiophene - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Cyclic ketone - Thioenolether - Ketone - Ketene acetal or derivatives - Carboxylic acid ester - Carboxylic acid salt - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Ether - Organic oxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Organonitrogen compound - 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