Compound Identification
SMILES
CC1=CC=CC=C1CN\C(N=O)=C1/ONC(Br)=C1
InChIKey
InChIKey=KJVFQSUSHOPUQE-ZRDIBKRKSA-N
Formula
C12H12BrN3O2
Mass
310.151
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Toluenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Not available
Direct Parent
Toluenes
Alternative Parents
Isoxazolines Ketene acetals Vinyl bromides Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds N-organohydroxylamines C-nitroso compounds Bromoalkenes Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Toluene - Isoxazoline - Ketene acetal or derivatives - C-nitroso compound - Organic nitroso compound - Vinyl bromide - Vinyl halide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Haloalkene - Bromoalkene - Oxacycle - Azacycle - N-organohydroxylamine - Organobromide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as toluenes. These are compounds containing a benzene ring which bears a methane group.
External Descriptors
Not available