Compound Identification
SMILES
[O-][N+]1=NN(N=C2C(Br)=CC(=O)C=C12)C12CC3CC(CC(C3)C1)C2
InChIKey
InChIKey=XKBQZFPLUTYBQP-UHFFFAOYSA-N
Formula
C16H17BrN4O2
Mass
377.242
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Tetrazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Tetrazines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tetrazines
Alternative Parents
Benzenoids Aryl bromides Vinylogous halides Heteroaromatic compounds Cyclic ketones Azacyclic compounds Organonitrogen compounds Organobromides Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aryl bromide - Aryl halide - Tetrazine - Benzenoid - Heteroaromatic compound - Vinylogous halide - Cyclic ketone - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetrazines. These are organic compounds containing a tetrazine ring, which is a six-membered aromatic heterocycle made up of four nitrogen atoms and a two carbon atoms.
External Descriptors
Not available