Compound Identification
SMILES
[Na+].[O-]C1=C(I)C=C(C=C1I)C#N
InChIKey
InChIKey=QGKPUZOFTJQTHL-UHFFFAOYSA-M
Formula
C7H2I2NNaO
Mass
392.898
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzonitriles
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzonitriles
Intermediate Tree Nodes
Not available
Direct Parent
Benzonitriles
Alternative Parents
Phenoxides Iodobenzenes Aryl iodides Organic metal halides Nitriles Organopnictogen compounds Organooxygen compounds Organoiodides Organic sodium salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzonitrile - Halobenzene - Iodobenzene - Phenoxide - Aryl halide - Aryl iodide - Organic metal halide - Organic alkali metal salt - Carbonitrile - Nitrile - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organoiodide - Organohalogen compound - Organic salt - Organic sodium salt - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.
External Descriptors
Not available