Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1=C(CN2N=CC3=CC=CC=C3C2=O)C=C(Br)C=C1

InChIKey

InChIKey=PGJIRDKEOPTKBS-UHFFFAOYSA-N

Formula

C16H11BrN2O3

Mass

359.179

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazanaphthalenes

Subclass

Benzodiazines

Intermediate Tree Nodes

Phthalazines

Direct Parent

Phthalazinones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phthalazinone - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 4-halobenzoic acid - Halobenzoic acid - Benzoic acid or derivatives - Benzoic acid - Benzoyl - Bromobenzene - Halobenzene - Pyridazinone - Aryl halide - Pyridazine - Benzenoid - Monocyclic benzene moiety - Aryl bromide - Heteroaromatic compound - Lactam - Azacycle - Carboxylic acid derivative - Carboxylic acid - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phthalazinones. These are compounds containing a phthalazine bearing a ketone group.

External Descriptors

Not available

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