Structure Information
Structure

Compound Identification

SMILES

OC1(NC(=O)NC(C1C(=O)C1=CN=CC=C1)C1=CC=C(C=C1)[N+]([O-])=O)C(F)(F)F

InChIKey

InChIKey=JVUOXXNQZWNLDX-UHFFFAOYSA-N

Formula

C17H13F3N4O5

Mass

410.309

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Nitrobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Nitrobenzenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Nitrobenzene - Nitroaromatic compound - Aryl ketone - Aryl alkyl ketone - Pyrimidone - 1,3-diazinane - Pyridine - Pyrimidine - Heteroaromatic compound - Fluorohydrin - Halohydrin - Ketone - C-nitro compound - Carbonic acid derivative - Urea - Organic nitro compound - Organoheterocyclic compound - Alkanolamine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic nitrogen compound - Organofluoride - Organohalogen compound - Carbonyl group - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.

External Descriptors

Not available

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