Compound Identification
SMILES
[O-][N+](=O)C1=CC=CC(=C1)C(=O)NNC1=NC=NC(NC2=NC=C(Br)C=C2)=C1[N+]([O-])=O
InChIKey
InChIKey=GTZUFNGEEHYCMJ-UHFFFAOYSA-N
Formula
C16H11BrN8O5
Mass
475.219
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
Benzoic acids and derivatives Benzoyl derivatives Nitroaromatic compounds Aminopyridines and derivatives Aminopyrimidines and derivatives Aryl bromides Imidolactams Heteroaromatic compounds Carboxylic acid hydrazides Amino acids and derivatives Secondary amines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic oxides Organic zwitterions Hydrocarbon derivatives Organobromides Organooxygen compounds Organic salts
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoic acid or derivatives - Nitrobenzene - Nitroaromatic compound - Benzoyl - Aminopyridine - Aminopyrimidine - Aryl bromide - Aryl halide - Imidolactam - Pyridine - Pyrimidine - Heteroaromatic compound - Amino acid or derivatives - Organic nitro compound - Carboxylic acid hydrazide - C-nitro compound - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Secondary amine - Organic oxide - Organic oxygen compound - Organic salt - Hydrocarbon derivative - Organohalogen compound - Amine - Organobromide - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic nitrogen compound - 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