Structure Information
Structure

Compound Identification

SMILES

CCC1=CC=C(NC2=C(Cl)C(=O)C3=C(C=NC=C3)C2=O)C=C1

InChIKey

InChIKey=QJGDPRCMNRLKMA-UHFFFAOYSA-N

Formula

C17H13ClN2O2

Mass

312.75

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isoquinolines and derivatives

Subclass

Isoquinoline quinones

Intermediate Tree Nodes

Not available

Direct Parent

Isoquinoline quinones

Alternative Parents

Aryl ketones Aniline and substituted anilines Pyridines and derivatives Vinylogous halides Vinylogous amides Heteroaromatic compounds Alpha-chloroketones Vinyl chlorides Enamines Chloroalkenes Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoquinoline quinone - Aryl ketone - Aniline or substituted anilines - Monocyclic benzene moiety - Pyridine - Benzenoid - Alpha-haloketone - Alpha-chloroketone - Vinylogous halide - Vinylogous amide - Heteroaromatic compound - Ketone - Azacycle - Chloroalkene - Haloalkene - Enamine - Vinyl chloride - Vinyl halide - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoquinoline quinones. These are isoquinoline derivative with a structure containing a 5,8-dihydroisoquinoline-5,8-dione skeleton.

External Descriptors

Not available

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