Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C(=O)C(SCC2=CC=CO2)=CC1=O

InChIKey

InChIKey=WYZOKYDHQRFHFK-UHFFFAOYSA-N

Formula

C13H12O5S

Mass

280.29

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones - Quinones - Benzoquinones

Direct Parent

P-benzoquinones

Alternative Parents

Vinylogous thioesters Vinylogous esters Heteroaromatic compounds Furans Thioenol ethers Sulfenyl compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

P-benzoquinone - Vinylogous thioester - Heteroaromatic compound - Vinylogous ester - Furan - Thioenolether - Oxacycle - Organoheterocyclic compound - Sulfenyl compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as p-benzoquinones. These are benzoquinones where the two C=O groups are attached at the 1- and 4-positions, respectively.

External Descriptors

Not available

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