Structure Information
Structure

Compound Identification

SMILES

COC(OC)(OC)C1=CC2=CC=CC=C2C(=O)N1

InChIKey

InChIKey=NQBRJQFNQDAFOV-UHFFFAOYSA-N

Formula

C13H15NO4

Mass

249.266

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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

Pyridinones Ortho esters Carboxylic acid orthoesters Benzenoids Heteroaromatic compounds Lactams Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoquinolone - Carboxylic acid orthoester - Ortho ester - Pyridinone - Pyridine - Benzenoid - Heteroaromatic compound - Orthocarboxylic acid derivative - Lactam - Azacycle - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen 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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