Compound Identification
SMILES
[O-]C1=C(Br)[N+](=NO1)C1=CC=CC=C1C#N
InChIKey
InChIKey=VYZQCCUKCXBNBZ-UHFFFAOYSA-N
Formula
C9H4BrN3O2
Mass
266.054
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
Aryl bromides Heteroaromatic compounds 1,2,3-oxadiazoles Oxacyclic compounds Nitriles Azacyclic compounds Organooxygen compounds Organobromides Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzonitrile - Aryl bromide - Aryl halide - Azole - Oxadiazole - 1,2,3-oxadiazole - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Oxacycle - Carbonitrile - Nitrile - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Cyanide - Organic salt - Organic cation - Aromatic heteromonocyclic 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