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Structure Information
Structure

Compound Identification

SMILES

NC1=C2C(=CS1)C(=NN(C2=O)C1=CC=C(Cl)C=C1)C(=O)NN=CC1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=PIHHQNJJEIKTGP-UHFFFAOYSA-N

Formula

C20H13ClN6O4S

Mass

468.87

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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 heteropolycyclic compounds

Substituents

Nitrobenzene - Thieno[3,4-d]pyridazine - Thienopyridazine - Nitroaromatic compound - Chlorobenzene - Halobenzene - Pyridazinone - Aryl chloride - Aryl halide - Pyridazine - 2-aminothiophene - Heteroaromatic compound - Vinylogous amide - Thiophene - Amino acid or derivatives - Lactam - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Organoheterocyclic compound - Organic zwitterion - Organohalogen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Primary amine - Organic nitrogen compound - Organic oxide - Organic salt - Aromatic heteropolycyclic 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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