Structure Information
Structure

Compound Identification

SMILES

COC1=C(O)C=C(CN\C=C2/C(=O)NC(=O)C3=C2C=C(Cl)C=C3)C=C1

InChIKey

InChIKey=BRUYFWSHHYMOMJ-ZROIWOOFSA-N

Formula

C18H15ClN2O4

Mass

358.78

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isoquinolines and derivatives

Subclass

1,3-isoquinolinediones

Intermediate Tree Nodes

Not available

Direct Parent

1,3-isoquinolinediones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1,3-isoquinolinedione - Isoquinolone - Methoxyphenol - Tetrahydroisoquinoline - Phenoxy compound - Anisole - Methoxybenzene - Benzylamine - Phenol ether - Phenylmethylamine - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Aralkylamine - Phenol - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Benzenoid - Carboxylic acid imide, n-unsubstituted - Carboxylic acid imide - Vinylogous amide - Dicarboximide - Carboxylic acid derivative - Azacycle - Ether - Secondary aliphatic amine - Enamine - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1,3-isoquinolinediones. These are isoquinoline derivatives carrying one C=O group at positions 1, and 3 respectively.

External Descriptors

Not available

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