Compound Identification
SMILES
OC(CC(CC1=CC=CC=C1)=NNC1=C(C=C(C=C1)[N+]([O-])=O)[N+]([O-])=O)(C(F)(F)F)C(F)(F)F
InChIKey
InChIKey=QTCDOJBTHMJMAP-UHFFFAOYSA-N
Formula
C18H14F6N4O5
Mass
480.323
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
Phenylhydrazines Nitroaromatic compounds Tertiary alcohols Fluorohydrins Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrazones Organofluorides Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrobenzene - Nitroaromatic compound - Phenylhydrazine - Tertiary alcohol - Fluorohydrin - Halohydrin - C-nitro compound - Organic nitro compound - Hydrazone - Organic oxoazanium - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Alkyl fluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Alcohol - Organic oxygen compound - Organic salt - Alkyl halide - Organic zwitterion - Organic nitrogen compound - Aromatic homomonocyclic 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