Compound Identification
SMILES
[O-][N+](=O)C1=CC2=C(C(=NO2)C2OCCO2)C(SCC2=CC=CO2)=C1
InChIKey
InChIKey=OJVIJUNXUFFSNJ-UHFFFAOYSA-N
Formula
C15H12N2O6S
Mass
348.33
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
Thiophenol ethers Nitroaromatic compounds Alkylarylthioethers 1,3-dioxolanes Furans Heteroaromatic compounds Isoxazoles Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Sulfenyl compounds Acetals Organic oxoazanium compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzisoxazole - Aryl thioether - Nitroaromatic compound - Thiophenol ether - Alkylarylthioether - Benzenoid - Meta-dioxolane - Azole - Furan - Isoxazole - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Sulfenyl compound - Oxacycle - Thioether - Acetal - Organic 1,3-dipolar compound - Organic oxoazanium - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen 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