Compound Identification
SMILES
[Ni].[Br-].[Br-].C[N+](C)(C)CCCCCCCCCCCCOC1=CC(=O)\C(C=C1)=N/NC1=CC=C(C=C1)[N+]([O-])=O.C[N+](C)(C)CCCCCCCCCCCCOC1=CC(=O)\C(C=C1)=N\NC1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=DOSZJGBUJBFUMQ-UHFFFAOYSA-N
Formula
C54H82Br2N8NiO8
Mass
1189.799
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 Vinylogous esters Tetraalkylammonium salts Cyclic ketones Propargyl-type 1,3-dipolar organic compounds Organic transition metal salts Organic oxoazanium compounds Organic metal bromide salts Hydrazones Organic zwitterions Organic oxides Organic bromide salts Hydrocarbon derivatives Amines
Molecular Framework
Not available
Substituents
Nitrobenzene - Nitroaromatic compound - Phenylhydrazine - Tetraalkylammonium salt - Quaternary ammonium salt - Vinylogous ester - Ketone - C-nitro compound - Organic nitro compound - Cyclic ketone - Hydrazone - Organic oxoazanium - Organic metal bromide salt - Organic transition metal salt - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Organic zwitterion - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organic salt - Organic bromide salt - 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