Compound Identification
SMILES
CC1=CC(C)=C(N\C=C2\C(=O)N(N=C2C(F)(F)F)C2=CC=C(C=C2)[N+]([O-])=O)C(C)=C1
InChIKey
InChIKey=ARYUCRNQOVOHEW-MHWRWJLKSA-N
Formula
C20H17F3N4O3
Mass
418.376
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Nitrobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrobenzenes
Alternative Parents
Aniline and substituted anilines Nitroaromatic compounds Pyrazolones Vinylogous amides Propargyl-type 1,3-dipolar organic compounds Allylamines Azacyclic compounds Organic oxoazanium compounds Carboxylic acids and derivatives Enamines Hydrocarbon derivatives Organic oxides Carbonyl compounds Organic salts Organic zwitterions Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Nitroaromatic compound - Aniline or substituted anilines - Pyrazolinone - Pyrazoline - Vinylogous amide - C-nitro compound - Organic nitro compound - Azacycle - Carboxylic acid derivative - Enamine - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Allylamine - Organoheterocyclic compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Organic zwitterion - Carbonyl group - Alkyl halide - Amine - Organic salt - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
External Descriptors
Not available