Structure Information
Structure

Compound Identification

SMILES

CC1=CC(NC2=NC(N)=C(C(NC3=CC=CC=C3F)=N2)[N+]([O-])=O)=CC=C1

InChIKey

InChIKey=ZOULRGJDKKCEDP-UHFFFAOYSA-N

Formula

C17H15FN6O2

Mass

354.345

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic 1,3-dipolar compounds

Class

Allyl-type 1,3-dipolar organic compounds

Subclass

Organic nitro compounds

Intermediate Tree Nodes

C-nitro compounds

Direct Parent

Nitroaromatic compounds

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aniline or substituted anilines - Nitroaromatic compound - Aminopyrimidine - Fluorobenzene - Halobenzene - Toluene - Imidolactam - Aryl halide - Benzenoid - Monocyclic benzene moiety - Aryl fluoride - Pyrimidine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxoazanium - Organic oxygen compound - Organonitrogen compound - Organofluoride - Primary amine - Organohalogen compound - Amine - Organic zwitterion - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitroaromatic compounds. These are c-nitro compounds where the nitro group is C-substituted with an aromatic group.

External Descriptors

Not available

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