Structure Information
Structure

Compound Identification

SMILES

[Cl-].COC1=C(OC)C=C2C(=O)N(CCC[NH3+])C3=C(C(=O)C4=C3C=CC3=CC=CC=C43)C2=C1

InChIKey

InChIKey=WUAZLTKXPRLBNM-UHFFFAOYSA-N

Formula

C25H23ClN2O4

Mass

450.92

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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 - Naphthalene - Anisole - Phenol ether - Aryl ketone - Alkyl aryl ether - Pyridinone - Pyridine - Benzenoid - Heteroaromatic compound - Quaternary ammonium salt - Vinylogous amide - Ketone - Lactam - Ether - Azacycle - Organic salt - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Primary aliphatic amine - Primary amine - Organic chloride salt - Organic oxide - Amine - Organic cation - 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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