Structure Information
Structure

Compound Identification

SMILES

CCCOC(=O)C1=C(Cl)C=CC(=C1)N1C(=O)C2=CC=CC3=CC(Br)=CC(C1=O)=C23

InChIKey

InChIKey=QGKPISXDIMIVNN-UHFFFAOYSA-N

Formula

C22H15BrClNO4

Mass

472.72

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isoquinolines and derivatives

Subclass

Isoquinolones and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Isoquinolones and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoquinolone - Benzoate ester - Naphthalene - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Halobenzene - Chlorobenzene - Benzenoid - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Aryl bromide - Carboxylic acid imide, n-substituted - Vinylogous halide - Carboxylic acid imide - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoquinolones and derivatives. These are aromatic polycyclic compounds containing a ketone bearing isoquinoline moiety.

External Descriptors

Not available

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