Structure Information
Structure

Compound Identification

SMILES

FC(F)(F)C(OC(=O)C1=CC=CC(C(=O)OC(C#N)(C(F)(F)F)C(F)(F)F)=C1SC1=CC=CC=C1)(C#N)C(F)(F)F

InChIKey

InChIKey=QECVXTHUZXRLOL-UHFFFAOYSA-N

Formula

C22H8F12N2O4S

Mass

624.36

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Phthalic acid and derivatives - Phthalate esters

Direct Parent

m-Phthalate esters

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Meta-phthalic acid ester - Meta_phthalic_acid - Diarylthioether - Benzoate ester - O-sulfanylbenzoic acid or derivatives - Aryl thioether - Benzoyl - Thiophenol ether - Vinylogous thioester - Carboxylic acid ester - Sulfenyl compound - Thioether - Carboxylic acid derivative - Carbonitrile - Nitrile - Organic nitrogen compound - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Alkyl fluoride - Organic oxygen compound - Organosulfur compound - Organic oxide - Cyanide - Alkyl halide - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as m-phthalate esters. These are ester derivatives of m-phthalic acids, which are based on a benzene 1,3-dicarboxylic acid skeleton.

External Descriptors

Not available

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