Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C2=C(C=C1)[C@H](OC2=O)[C@@H]1N(C)CCC2=C1C(OC)=C(O)C(O)=C2S(Cl)(=O)=O

InChIKey

InChIKey=CZHQRBNDCJTZMW-PBHICJAKSA-N

Formula

C21H22ClNO9S

Mass

499.92

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Phthalide isoquinolines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Phthalide isoquinolines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phthalide isoquinoline - Benzofuranone - Isobenzofuranone - Phthalide - Tetrahydroisoquinoline - Isocoumaran - Anisole - Phenol ether - Alkyl aryl ether - Phenol - Aralkylamine - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl chloride - Sulfonyl halide - Sulfonyl - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Lactone - Ether - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phthalide isoquinolines. These are organic compounds with a structure characterized by an isoquinoline moiety linked to phthalide.

External Descriptors

Not available

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