Compound Identification
SMILES
COC1=C(C)C=C(SCC(COC2=CC=C(C=C2)C(F)(F)F)=CC#N)C=C1
InChIKey
InChIKey=WQNXNUCLPXRSOA-UHFFFAOYSA-N
Formula
C20H18F3NO2S
Mass
393.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Trifluoromethylbenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Trifluoromethylbenzenes
Alternative Parents
Thiophenol ethers Phenoxy compounds Methoxybenzenes Anisoles Toluenes Alkylarylthioethers Alkyl aryl ethers Sulfenyl compounds Nitriles Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Trifluoromethylbenzene - Anisole - Phenol ether - Thiophenol ether - Methoxybenzene - Aryl thioether - Phenoxy compound - Alkyl aryl ether - Alkylarylthioether - Toluene - Sulfenyl compound - Ether - Thioether - Carbonitrile - Nitrile - Alkyl halide - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organosulfur compound - Alkyl fluoride - Hydrocarbon derivative - Cyanide - Organic nitrogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors
Not available