Structure Information
Structure

Compound Identification

SMILES

C[C@H](OC1=C(CC=C)C=CC(OC2=C(C)N(C3=C2C=C(OC(F)(F)F)C=C3)C2=NOC3=C2C=CC(Cl)=C3)=C1)C(O)=O

InChIKey

InChIKey=ABLXPAUNENWMIY-INIZCTEOSA-N

Formula

C29H22ClF3N2O6

Mass

586.95

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

2-phenoxypropionic acids

Intermediate Tree Nodes

Not available

Direct Parent

2-phenoxypropionic acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-phenoxypropionic acid - Phenoxyacetate - Diaryl ether - Indole or derivatives - Indole - Benzisoxazole - Phenoxy compound - Phenol ether - Alkyl aryl ether - Aryl chloride - Aryl halide - Substituted pyrrole - Isoxazole - Pyrrole - Azole - Heteroaromatic compound - Trihalomethane - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Ether - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Halomethane - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-phenoxypropionic acids. These are aromatic compounds hat contain a phenol ether attached to the C2-atom of a phenylpropionic acid.

External Descriptors

Not available

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