Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=C(C=C1)C1OB(OCC1NC(=O)C(Cl)Cl)C1=CC(=CC=C1)[N+]([O-])=O

InChIKey

InChIKey=LULBLTMQFHQNBU-UHFFFAOYSA-N

Formula

C17H14BCl2N3O7

Mass

454.02

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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 - Boronic acid ester - Boronic acid derivative - Carboxamide group - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Carboxylic acid derivative - Oxacycle - Organic oxoazanium - Organic metalloid salt - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organonitrogen compound - Organochloride - Organic metalloid moeity - Organohalogen compound - Alkyl halide - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - Organic zwitterion - Organic oxygen compound - Carbonyl group - Organic oxide - Organic salt - Alkyl chloride - 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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