Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C(C=C2OC(=O)C3=C2C=CC=C3Cl)C=C1

InChIKey

InChIKey=FMDFGQIZYVZARV-UHFFFAOYSA-N

Formula

C17H13ClO4

Mass

316.74

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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

Isobenzofuranones

Alternative Parents

Dimethoxybenzenes Phenoxy compounds Anisoles Alkyl aryl ethers Aryl chlorides Vinylogous halides Enol esters Lactones Oxacyclic compounds Monocarboxylic acids and derivatives Organochlorides Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isobenzofuranone - O-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Aryl chloride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Vinylogous halide - Enol ester - Carboxylic acid ester - Lactone - Oxacycle - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Organic oxide - Organooxygen compound - Organic oxygen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isobenzofuranones. These are compounds containing a 2-benzofuran moiety that carries an oxo group at the 1 position.

External Descriptors

Not available

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