Compound Identification
SMILES
CSC1=C(C(NC2=C(Cl)C=C(C=N2)C(F)(F)F)=C(C=C1C(F)(F)F)[N+]([O-])=O)[N+]([O-])=O
InChIKey
InChIKey=WYINKYXDUMTESU-UHFFFAOYSA-N
Formula
C14H7ClF6N4O4S
Mass
476.73
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
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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
Nitrobenzenes Thiophenol ethers Aniline and substituted anilines Nitroaromatic compounds Alkylarylthioethers Aminopyridines and derivatives Aryl chlorides Imidolactams Heteroaromatic compounds Sulfenyl compounds Secondary amines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organofluorides Alkyl fluorides Hydrocarbon derivatives Organochlorides Organic zwitterions Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Aniline or substituted anilines - Thiophenol ether - Aminopyridine - Alkylarylthioether - Aryl chloride - Aryl halide - Pyridine - Imidolactam - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Organic oxoazanium - Azacycle - Secondary amine - Thioether - Organoheterocyclic compound - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organosulfur compound - Organonitrogen compound - Organofluoride - Organochloride - Alkyl fluoride - Organohalogen compound - Alkyl halide - Amine - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic 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