Structure Information
Structure

Compound Identification

SMILES

[O-][Cl](=O)(=O)=O.COC1=CC=C(C=C1)[N+]1=NC(=NN(C1)C1=CC=CC=C1)C1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=IMMKGUBYCGURGU-UHFFFAOYSA-M

Formula

C21H18ClN5O7

Mass

487.85

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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 - Methoxyaniline - Phenoxy compound - Nitroaromatic compound - Anisole - Diazonium perchlorate - Phenol ether - Methoxybenzene - Alkyl aryl ether - Organic perchlorate - Organic perchlorate salt - C-nitro compound - Organic chlorate - Organic nitro compound - Organoheterocyclic compound - Ether - Hydrazone - Organic oxoazanium - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic salt - Organic nitrogen compound - Organic oxide - Organic oxygen 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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