Compound Identification
SMILES
CCOC(=O)C1=C(NC2=CC3=C(C=C2)C(N)=NO3)C2=C(O1)C=NC=C2
InChIKey
InChIKey=ZOCVUQLFLRLHCF-UHFFFAOYSA-N
Formula
C17H14N4O4
Mass
338.323
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzisoxazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzisoxazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzisoxazoles
Alternative Parents
Furo[2,3-c]pyridines Furoic acid esters Benzenoids Imidolactams Primary aromatic amines Pyridines and derivatives Isoxazoles Heteroaromatic compounds Vinylogous amides Amino acids and derivatives Carboxylic acid esters Azacyclic compounds Secondary amines Oxacyclic compounds Organic oxides Hydrocarbon derivatives Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Furoic acid ester - Furo[2,3-c]pyridine - Furopyridine - Benzisoxazole - Furoic acid or derivatives - Imidolactam - Benzenoid - Primary aromatic amine - Pyridine - Azole - Heteroaromatic compound - Furan - Isoxazole - Vinylogous amide - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Oxacycle - Azacycle - Secondary amine - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Organonitrogen compound - Organooxygen compound - Primary amine - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzisoxazoles. These are aromatic compounds containing a benzene ring fused to an isoxazole ring. Isoxazole is five-membered ring with three carbon atoms, and an oxygen atom next to a nitrogen atom.
External Descriptors
Not available