Structure Information
Structure

Compound Identification

SMILES

CNC(=O)CCCN1C=C(Br)C2=CC(OC)=C(OC)C=C2C1=O

InChIKey

InChIKey=SLKMMTRKAOQUMS-UHFFFAOYSA-N

Formula

C16H19BrN2O4

Mass

383.242

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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

Anisoles Pyridinones Alkyl aryl ethers N-acyl amines Aryl bromides Heteroaromatic compounds Secondary carboxylic acid amides Lactams Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoquinolone - Anisole - Phenol ether - Alkyl aryl ether - Pyridinone - Aryl bromide - Aryl halide - Fatty acyl - Benzenoid - Pyridine - Fatty amide - N-acyl-amine - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Lactam - Azacycle - Carboxylic acid derivative - Ether - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organobromide - Organohalogen compound - 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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