Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C2C(=O)N(C)C([C@@H](C(O)=O)C2=C1)C1=CC2=C(OCO2)C=C1

InChIKey

InChIKey=YSIADTHTRFFQPJ-ZENAZSQFSA-N

Formula

C20H19NO7

Mass

385.372

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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

Tetrahydroisoquinolines Benzodioxoles Anisoles Alkyl aryl ethers Tertiary carboxylic acid amides Lactams Monocarboxylic acids and derivatives Acetals Carboxylic acids Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds Organopnictogen compounds Organic oxides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoquinolone - Tetrahydroisoquinoline - Benzodioxole - Anisole - Alkyl aryl ether - Benzenoid - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Acetal - Carboxylic acid derivative - Carboxylic acid - Ether - Oxacycle - Monocarboxylic acid or derivatives - Azacycle - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxide - 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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