Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(NC2=CC=CC=C2C#N)C2=NON=C12
InChIKey
InChIKey=LEQGBODIVWXCGB-UHFFFAOYSA-N
Formula
C13H7N5O3
Mass
281.231
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 Benzonitriles Nitroaromatic compounds Furazans Heteroaromatic compounds Secondary amines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Nitriles Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxadiazole - Nitroaromatic compound - Benzonitrile - Aniline or substituted anilines - Monocyclic benzene moiety - Benzenoid - Azole - Furazan - Heteroaromatic compound - Oxadiazole - C-nitro compound - Organic nitro compound - Carbonitrile - Nitrile - Organic oxoazanium - Oxacycle - Secondary amine - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic zwitterion - Cyanide - Organic oxide - Amine - Organic salt - 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