Structure Information
Structure

Compound Identification

SMILES

C[C@H]1[C@@H](NC(=O)CS)OC(=O)N1C1=CC(F)=C(C=C1)C(N)=O

InChIKey

InChIKey=WZAXNTFYMXECOM-QTTZVWFDSA-N

Formula

C13H14FN3O4S

Mass

327.33

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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

Halobenzoic acids and derivatives

Direct Parent

2-halobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-halobenzoic acid or derivatives - Benzamide - Benzoyl - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Oxazolidinone - Oxazolidine - Vinylogous halide - Carbamic acid ester - Carboxamide group - Secondary carboxylic acid amide - Primary carboxylic acid amide - Azacycle - Oxacycle - Carboxylic acid derivative - Alkylthiol - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 2-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 2-position of the benzene ring.

External Descriptors

Not available

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