Structure Information
Structure

Compound Identification

SMILES

OC(=O)CSC1=C(C=C(C=C1[N+]([O-])=O)C(F)(F)F)[N+]([O-])=O

InChIKey

InChIKey=YNNGGTUSAOUEHJ-UHFFFAOYSA-N

Formula

C9H5F3N2O6S

Mass

326.2

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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

Trifluoromethylbenzene - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Thiophenol ether - Alkylarylthioether - C-nitro compound - Organic nitro compound - Carboxylic acid derivative - Carboxylic acid - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Monocarboxylic acid or derivatives - Thioether - Organic oxoazanium - Organic oxide - Organooxygen compound - Organonitrogen compound - Organofluoride - Organosulfur compound - Organohalogen compound - Organic nitrogen compound - Alkyl fluoride - Organic oxygen compound - Organopnictogen compound - Alkyl halide - Carbonyl group - Hydrocarbon derivative - 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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