Structure Information
Structure

Compound Identification

SMILES

CC(C)C1=CC(C=C2OC(=O)C3=CC=CC=C23)=CC(C(C)C)=C1O

InChIKey

InChIKey=ALLFLNROQAQEBN-UHFFFAOYSA-N

Formula

C21H22O3

Mass

322.404

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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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isobenzofuranone - Cumene - Phenylpropane - Phenol - Benzenoid - Monocyclic benzene moiety - Enol ester - Lactone - Carboxylic acid ester - Oxacycle - Carboxylic acid derivative - Organic oxide - Organooxygen compound - Organic oxygen 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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