Structure Information
Structure

Compound Identification

SMILES

CC1=NC=C(OS(=O)(=O)C(F)(F)F)C=C1

InChIKey

InChIKey=NSSSVJYQTZRVMH-UHFFFAOYSA-N

Formula

C7H6F3NO3S

Mass

241.18

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Organic sulfonic acids and derivatives

Subclass

Organosulfonic acids and derivatives

Intermediate Tree Nodes

Alkanesulfonic acids and derivatives - Alkanesulfonic acids

Direct Parent

Trifluoromethanesulfonates

Alternative Parents

Methylpyridines Sulfonic acid esters Organosulfonic acid esters Sulfonyls Methanesulfonates Heteroaromatic compounds Trihalomethanes Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Trifluoromethanesulfonate - Methylpyridine - Pyridine - Sulfonic acid ester - Organosulfonic acid ester - Methanesulfonate - Sulfonyl - Heteroaromatic compound - Trihalomethane - Azacycle - Organoheterocyclic compound - Alkyl fluoride - Hydrocarbon derivative - Halomethane - Organic oxide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as trifluoromethanesulfonates. These are alkanesulfonic acids, that contain a sulfonate group that is substituted with a trifluoromethyl group.

External Descriptors

Not available

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