Compound Identification
SMILES
[O-]S([O-])(=O)=O.[O-][N+](=O)C1=CC(=C(C=C1)[N+]#N)[N+]([O-])=O.[O-][N+](=O)C1=CC(=C(C=C1)[N+]#N)[N+]([O-])=O
InChIKey
InChIKey=LQTWAYRVPSCETI-UHFFFAOYSA-L
Formula
C12H6N8O12S
Mass
486.28
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
Nitroaromatic compounds Organic sulfate salts Organic sulfuric acids and derivatives Organic diazonium salts Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Nitrobenzene - Nitroaromatic compound - Organic sulfate salt - Organic sulfuric acid or derivatives - C-nitro compound - Organic diazonium salt - Organic nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organopnictogen compound - Organic salt - Hydrocarbon derivative - 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