Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=CC(CN2C(=O)SC(=CC3=CC(Br)=C(OCC=C)C(Br)=C3)C2=O)=C1

InChIKey

InChIKey=LIGGMIFWJUZOIP-UHFFFAOYSA-N

Formula

C20H14Br2N2O5S

Mass

554.21

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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 - Phenoxy compound - Nitroaromatic compound - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Thiazolidinedione - Aryl bromide - Aryl halide - Dicarboximide - Thiazolidine - Organic nitro compound - C-nitro compound - Thiocarbamic acid derivative - Carboxylic acid derivative - Azacycle - Ether - Organoheterocyclic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organic salt - Organic oxide - Organic oxygen compound - Organohalogen compound - Carbonyl group - Organobromide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - 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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