Structure Information
Structure

Compound Identification

SMILES

COC1=C(C=C(CN2C(C)=NC(=C2SCC(=O)NN=C(C)C2=CC=C(F)C=C2)[N+]([O-])=O)C=C1)[N+]([O-])=O

InChIKey

InChIKey=SPBNOYRZDYXSKB-UHFFFAOYSA-N

Formula

C22H21FN6O6S

Mass

516.5

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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

Nitrophenyl ethers

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Nitrophenyl ether - 1,2,4,5-tetrasubstituted imidazole - Methoxyaniline - Phenoxy compound - Aryl thioether - Nitroaromatic compound - Anisole - Nitroimidazole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Fluorobenzene - Halobenzene - Alkylarylthioether - Imidolactam - Aryl fluoride - Aryl halide - N-substituted imidazole - Heteroaromatic compound - Azole - Imidazole - Organic nitro compound - C-nitro compound - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Ether - Sulfenyl compound - Thioether - Organic oxoazanium - Organic zwitterion - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic salt - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitrophenyl ethers. These are aromatic compounds containing a nitrobenzene moiety that carries an ether group on the benzene ring.

External Descriptors

Not available

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