Compound Identification
SMILES
CCOC(=O)C(C)OC1=CC=C(C=C2SC3=NC(C)=C(C(N3C2=O)C2=CC=CC=C2Cl)C(=O)OC(C)C)C=C1
InChIKey
InChIKey=PTCYXVXKEBFNHE-UHFFFAOYSA-N
Formula
C29H29ClN2O6S
Mass
569.07
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
2-phenoxypropionic acid esters
Intermediate Tree Nodes
Not available
Direct Parent
2-phenoxypropionic acid esters
Alternative Parents
Phenoxyacetic acid derivatives Phenoxy compounds Phenol ethers Alkyl aryl ethers Chlorobenzenes Aryl chlorides Dicarboxylic acids and derivatives Thiazoles Enoate esters Heteroaromatic compounds Lactams Isothioureas Azacyclic compounds Organonitrogen compounds Organic oxides Carbonyl compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenoxypropionic acid ester - Phenoxyacetate - Phenol ether - Phenoxy compound - Halobenzene - Alkyl aryl ether - Chlorobenzene - Aryl chloride - Dicarboxylic acid or derivatives - Aryl halide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Thiazole - Heteroaromatic compound - Azole - Carboxylic acid ester - Lactam - Isothiourea - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Ether - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-phenoxypropionic acid esters. These are aromatic compounds hat contain a phenol ether attached to the C2-atom of a phenylpropionic acid ester.
External Descriptors
Not available