Compound Identification
SMILES
[O-]S(=O)(=O)C(F)(F)F.CC1=CC=C(C=C1)S(=O)(=O)C[N+]1=CC(C)=CC(C)=C1
InChIKey
InChIKey=KALQSGHDEFUSEL-UHFFFAOYSA-M
Formula
C16H18F3NO5S2
Mass
425.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Toluenes
- Level 5 Tosyl compounds
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Subclass
Toluenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Not available
Direct Parent
Tosyl compounds
Alternative Parents
Benzenesulfonyl compounds Trifluoromethanesulfonates Methylpyridines Pyridinium derivatives Sulfones Organosulfonic acids Heteroaromatic compounds Methanesulfonates Trihalomethanes Azacyclic compounds Alkyl fluorides Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds Organic cations
Molecular Framework
Not available
Substituents
Tosyl compound - Benzenesulfonyl group - Trifluoromethanesulfonate - Methylpyridine - Pyridine - Pyridinium - Methanesulfonate - Sulfone - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Alkanesulfonic acid - Sulfonyl - Trihalomethane - Azacycle - Organoheterocyclic compound - Alkyl halide - Organic oxide - Hydrocarbon derivative - Alkyl fluoride - Halomethane - Organosulfur compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as tosyl compounds. These are organosulfur compounds containing a tosyl group, with the general formula CH3C6H4S(O2)R (R = any atom).
External Descriptors
Not available