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Structure Information
Structure

Compound Identification

SMILES

COC1=C(O)C(OC)=C2C(CCC(NC(C)=O)C3=CC(=O)C(SC)=CC=C23)=C1

InChIKey

InChIKey=OMQLBXIHBJAOIO-UHFFFAOYSA-N

Formula

C21H23NO5S

Mass

401.48

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Hydrocarbon derivatives

Class

Tropones

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Tropones

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Aryl thioether - Anisole - Tropone - Alkyl aryl ether - Alkylarylthioether - Benzenoid - Acetamide - Carboxamide group - Secondary carboxylic acid amide - Cyclic ketone - Carboxylic acid derivative - Ether - Thioether - Sulfenyl compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Organosulfur compound - Organic oxide - Carbonyl group - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as tropones. These are compounds containing a tropone ring, which is a cycloheptatrienone ring bearing a ketone group.

External Descriptors

Not available

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