Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC(CN(C(=O)C(C)SC2=C(C=C(C=C2)C(F)(F)F)[N+]([O-])=O)S(C)(=O)=O)=C1OC

InChIKey

InChIKey=YJFYHXCVKIEXGM-UHFFFAOYSA-N

Formula

C20H21F3N2O7S2

Mass

522.51

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Trifluoromethylbenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Trifluoromethylbenzenes

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Dimethoxybenzene - O-dimethoxybenzene - Trifluoromethylbenzene - Nitrobenzene - Anisole - Phenol ether - Thiophenol ether - Phenoxy compound - Aryl thioether - Methoxybenzene - Nitroaromatic compound - Alkyl aryl ether - Alkylarylthioether - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Organic nitro compound - C-nitro compound - Carboxylic acid derivative - Ether - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Thioether - Sulfenyl compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Hydrocarbon derivative - Organohalogen compound - Organic nitrogen compound - Organic oxide - Organosulfur compound - Alkyl fluoride - Organic salt - Carbonyl group - Organic zwitterion - Alkyl halide - Organic oxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.

External Descriptors

Not available

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