Compound Identification
SMILES
COC(=O)C1=C(OCC2=CC=CC=C2)C(=O)N2OC3=CC=CC(N4CCOCC4)=C3C2=N1
InChIKey
InChIKey=ANPLZPRTHJMCRP-UHFFFAOYSA-N
Formula
C23H21N3O6
Mass
435.436
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
Pyrimidinecarboxylic acids Dialkylarylamines Pyrimidones Alkyl aryl ethers Morpholines Benzene and substituted derivatives Methyl esters Isoxazoles Heteroaromatic compounds Amino acids and derivatives Lactams Oxacyclic compounds Azacyclic compounds Dialkyl ethers Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzisoxazole - Pyrimidine-6-carboxylic acid - Pyrimidine-6-carboxylic acid or derivatives - Dialkylarylamine - Alkyl aryl ether - Pyrimidone - Monocyclic benzene moiety - Morpholine - Oxazinane - Pyrimidine - Benzenoid - Heteroaromatic compound - Azole - Methyl ester - Isoxazole - Amino acid or derivatives - Tertiary amine - Lactam - Carboxylic acid ester - Azacycle - Oxacycle - Carboxylic acid derivative - Ether - Dialkyl ether - Hydrocarbon derivative - Amine - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - 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