Compound Identification
SMILES
NC1=CC=C(C=C1)C1C2=C(NO[N+]2=O)C(=CC1=[N+]([O-])[O-])[N+]([O-])=O
InChIKey
InChIKey=TYAOPXQOPUVLHO-UHFFFAOYSA-N
Formula
C12H9N5O6
Mass
319.233
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxadiazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxadiazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxadiazoles
Alternative Parents
Aniline and substituted anilines Nitronic acids C-nitro compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Azacyclic compounds Primary amines Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxadiazole - Aniline or substituted anilines - Monocyclic benzene moiety - Benzenoid - C-nitro compound - Nitronic acid - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Azacycle - Oxacycle - Hydrocarbon derivative - Organic salt - Organic oxide - Organic zwitterion - Primary amine - Organonitrogen compound - Amine - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxadiazoles. These are organic compounds containing a benzene fused to an oxadiazole ring (a five-membered ring with two carbon atoms, one nitrogen atom, and one oxygen atom).
External Descriptors
Not available