Structure Information
Structure

Compound Identification

SMILES

ClC1=C(Br)C=C(C=N1)S(=O)(=O)NC1=CC2=C(COC2=O)C=C1

InChIKey

InChIKey=WHSPKOSDJBDQBM-UHFFFAOYSA-N

Formula

C13H8BrClN2O4S

Mass

403.63

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isocoumarans

Subclass

Isobenzofuranones

Intermediate Tree Nodes

Not available

Direct Parent

Phthalides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyridine-3-sulfonamide - Sulfanilide - Phthalide - Polyhalopyridine - 2-halopyridine - Aryl bromide - Aryl chloride - Organosulfonic acid amide - Benzenoid - Aryl halide - Pyridine - Aminosulfonyl compound - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Heteroaromatic compound - Carboxylic acid ester - Lactone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organonitrogen compound - Organochloride - Organobromide - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phthalides. These are compounds containing a 3-hydrocarbylidene-2-benzofuran-1(3H)-one moiety,.

External Descriptors

Not available

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