Compound Identification
SMILES
CC(=O)NC1=C(C(=O)OCC(=O)NC2=C(C=C(C=C2)[N+]([O-])=O)C(F)(F)F)C2=C(CCCC2)S1
InChIKey
InChIKey=OFVZBVDZIBEEBX-UHFFFAOYSA-N
Formula
C20H18F3N3O6S
Mass
485.43
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
Anilides N-acetylarylamines Nitrobenzenes Thiophene carboxylic acids and derivatives Nitroaromatic compounds Vinylogous amides Acetamides Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic salts Organic zwitterions Hydrocarbon derivatives Organofluorides Alkyl fluorides Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - N-acetylarylamine - Nitrobenzene - Anilide - Thiophene carboxylic acid or derivatives - Nitroaromatic compound - N-arylamide - Thiophene - Heteroaromatic compound - Vinylogous amide - Acetamide - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organic oxoazanium - Organoheterocyclic compound - Alkyl fluoride - Organooxygen compound - Organonitrogen compound - Organofluoride - Organic zwitterion - Organohalogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Alkyl halide - Aromatic heteropolycyclic 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