Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(NC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)SC=C1C1=CC=CC=C1

InChIKey

InChIKey=HQLFFEHFTIEMIO-UHFFFAOYSA-N

Formula

C19H10F13NO3S

Mass

579.33

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organohalogen compounds

Class

Alkyl halides

Subclass

Alkyl fluorides

Intermediate Tree Nodes

Not available

Direct Parent

Perfluoroalkyl carboxylic acid and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Perfluoroalkyl carboxylic acid or derivatives - Thiophene carboxylic acid or derivatives - N-arylamide - Monocyclic benzene moiety - Fatty amide - Benzenoid - Fatty acyl - Vinylogous amide - Heteroaromatic compound - Methyl ester - Thiophene - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as perfluoroalkyl carboxylic acid and derivatives. These are organic compounds containing an alkyl chain attached to the C-alpha of a carboxylic acid group (or a derivative thereof), where all hydrogens of the alkyl chain are replaced by fluorine atoms.

External Descriptors

Not available

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