Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)COC1=C(F)C=C(SCCN)C=C1F

InChIKey

InChIKey=WXSBHZRUFOWXTK-UHFFFAOYSA-N

Formula

C12H15F2NO3S

Mass

291.31

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Phenoxyacetate - Phenoxy compound - Aryl thioether - Thiophenol ether - Phenol ether - Alkyl aryl ether - Alkylarylthioether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Sulfenyl compound - Ether - Thioether - Monocarboxylic acid or derivatives - Organic oxide - Primary aliphatic amine - Primary amine - Organic oxygen compound - Amine - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic homomonocyclic 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

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