Structure Information
Structure

Compound Identification

SMILES

COC1=C(C)C2=C(C(=O)OC2)C(NC(C)C)=C1C\C=C(/C)CCC(O)=O

InChIKey

InChIKey=SWSJTZHVCREUCX-WUXMJOGZSA-N

Formula

C20H27NO5

Mass

361.438

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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

Phthalide - Methoxyaniline - Anisole - Phenol ether - Medium-chain fatty acid - Alkyl aryl ether - Amino fatty acid - Branched fatty acid - Heterocyclic fatty acid - Methyl-branched fatty acid - Secondary aliphatic/aromatic amine - Fatty acyl - Fatty acid - Benzenoid - Unsaturated fatty acid - Vinylogous amide - Amino acid or derivatives - Amino acid - Carboxylic acid ester - Lactone - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Secondary amine - Carboxylic acid derivative - Oxacycle - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Amine - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic nitrogen 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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