Structure Information
Structure

Compound Identification

SMILES

O[C@H]1O[C@H](COC(=O)C2=CC=C(Cl)C=C2)[C@](O)(C#C)[C@H]1O

InChIKey

InChIKey=BHHWKAPNUFBDCK-UVLXDEKHSA-N

Formula

C14H13ClO6

Mass

312.7

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Benzoic acid esters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Pentose monosaccharide - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoate ester - Benzoyl - Chlorobenzene - Halobenzene - Aryl halide - Aryl chloride - Ynone - Monosaccharide - Tertiary alcohol - Oxolane - Carboxylic acid ester - Secondary alcohol - 1,2-diol - Hemiacetal - Acetylide - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Polyol - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organooxygen compound - Organochloride - Organohalogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.

External Descriptors

Not available

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