Compound Identification
SMILES
COC1=CC=C(NC2=NC(NN=CC3=CC=CC=C3F)=NC(NC3=CC=C(C=C3)[N+]([O-])=O)=N2)C=C1
InChIKey
InChIKey=RRMRPCOJTDBBNE-UHFFFAOYSA-N
Formula
C23H19FN8O3
Mass
474.456
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Nitrobenzenes
-
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
Methoxyanilines 1,3,5-triazine-2,4-diamines Phenoxy compounds Anisoles Nitroaromatic compounds Methoxybenzenes Alkyl aryl ethers Fluorobenzenes 1,3,5-triazines Aryl fluorides Heteroaromatic compounds Secondary amines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrazones Organofluorides Organic zwitterions Organic oxides Organic salts Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Methoxyaniline - Anisole - Phenoxy compound - 2,4-diamine-s-triazine - Nitroaromatic compound - Phenol ether - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Amino-1,3,5-triazine - Aminotriazine - Fluorobenzene - Halobenzene - 1,3,5-triazine - Aryl fluoride - Aryl halide - Triazine - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Allyl-type 1,3-dipolar organic compound - Ether - Hydrazone - Organic oxoazanium - Secondary amine - Organic salt - Organic nitrogen compound - Amine - Organic zwitterion - Organic oxygen compound - Organohalogen compound - Hydrocarbon derivative - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - 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