Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(\C=N/NC2=NC3=NON=C3N=C2NC2=CC(Br)=CC=C2)C=C1
InChIKey
InChIKey=ZMKYFDJVWFGGPW-OCKHKDLRSA-N
Formula
C17H11BrN8O3
Mass
455.232
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 Aminopyrazines Bromobenzenes Aryl bromides Imidolactams Heteroaromatic compounds Furazans Organic oxoazanium compounds Oxacyclic compounds Hydrazones Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Organobromides Hydrocarbon derivatives Organopnictogen compounds Organic salts Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrobenzene - Nitroaromatic compound - Aniline or substituted anilines - Aminopyrazine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Imidolactam - Pyrazine - Azole - Heteroaromatic compound - Furazan - Oxadiazole - Organic nitro compound - C-nitro compound - Oxacycle - Azacycle - Hydrazone - Organoheterocyclic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic salt - Organopnictogen compound - Organic oxygen compound - Organohalogen compound - Organic oxide - Organobromide - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic zwitterion - Aromatic heteropolycyclic 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