Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1=CC(=O)C2=CC(Br)=CC(NC(=O)C3=CC=C(C=C3)C#N)=C2O1

InChIKey

InChIKey=BFEJXEIMQKFBFT-UHFFFAOYSA-N

Formula

C18H9BrN2O5

Mass

413.183

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzopyrans

Subclass

1-benzopyrans

Intermediate Tree Nodes

Not available

Direct Parent

Chromones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Chromone - Benzamide - Benzoic acid or derivatives - Benzonitrile - Benzoyl - Pyranone - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyran - Benzenoid - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Carbonitrile - Nitrile - Organobromide - Organic oxide - Cyanide - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as chromones. These are compounds containing a benzopyran-4-one moiety.

External Descriptors

Not available

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