Structure Information
Structure

Compound Identification

SMILES

CS[C@@H]1[C@@H](C)O[C@H](C[C@@H]1OC(=O)C1=CC=CC=C1)OC(=N)C(Cl)(Cl)Cl

InChIKey

InChIKey=XMAFACCKJSELPP-LPTSXCQYSA-N

Formula

C16H18Cl3NO4S

Mass

426.73

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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

Benzoate ester - Benzoyl - Oxane - Carboxylic acid ester - Imido ester - Acetal - Carboximidic acid derivative - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Thioether - Sulfenyl compound - Dialkylthioether - Organoheterocyclic compound - Oxacycle - Organochloride - Organohalogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Alkyl chloride - Alkyl halide - Organopnictogen 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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