Structure Information
Structure

Compound Identification

SMILES

NC(N)=NCCNC1=NC(=O)N(CC2=CC=C(F)C=C2)C(=O)N1CC1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=SWSGLVRGFZXJIT-UHFFFAOYSA-N

Formula

C20H21FN8O4

Mass

456.438

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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 - Amino-1,3,5-triazine - Aminotriazine - Fluorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Triazinone - N-aliphatic s-triazine - Aryl fluoride - Aryl halide - 1,3,5-triazine - Triazine - Heteroaromatic compound - Guanidine - Organic nitro compound - C-nitro compound - Urea - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Secondary amine - Carboximidamide - Allyl-type 1,3-dipolar organic compound - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Organic salt - Organooxygen compound - Organohalogen compound - Organofluoride - Organic oxygen compound - Organic nitrogen compound - Amine - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic cation - 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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