Structure Information
Structure

Compound Identification

SMILES

NC1=C(C(=O)C(CC2=CC(=CC=C2)[N+]([O-])=O)O1)C1=CC(=CC=C1)C(F)(F)F

InChIKey

InChIKey=ABYHTFIQLJOEFV-UHFFFAOYSA-N

Formula

C18H13F3N2O4

Mass

378.307

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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 heteromonocyclic compounds

Substituents

Trifluoromethylbenzene - Nitrobenzene - Nitroaromatic compound - 3-furanone - Dihydrofuran - Vinylogous amide - Vinylogous ester - Ketene acetal or derivatives - Ketone - C-nitro compound - Cyclic ketone - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Oxacycle - Organic oxoazanium - Carbonyl group - Organonitrogen compound - Organofluoride - Organooxygen compound - Organohalogen compound - Organic oxide - Amine - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Organic nitrogen compound - Organic salt - Hydrocarbon derivative - Organic zwitterion - Aromatic heteromonocyclic 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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