Structure Information
Structure

Compound Identification

SMILES

NC1=CC(C(O)=O)C(=O)CC1=O

InChIKey

InChIKey=WDKCRYMPIAJNRI-UHFFFAOYSA-N

Formula

C7H7NO4

Mass

169.136

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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

M-benzoquinones

Alternative Parents

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

M-benzoquinone - Cyclohexenone - 1,3-diketone - 1,3-dicarbonyl compound - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Carboxylic acid - Enamine - Monocarboxylic acid or derivatives - Amine - Primary aliphatic amine - Organonitrogen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Aliphatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as m-benzoquinones. These are benzoquinones where the two C=O groups are attached at the 1- and 3-position, respectively.

External Descriptors

Not available

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