Compound Identification
SMILES
CC1=C(C=C(C=C1)C(=O)NC1CC1)C1=CC2=C(C=C1)C(CC(=O)N1CCCC1)=NO2
InChIKey
InChIKey=NGABSHSPLBYYJP-UHFFFAOYSA-N
Formula
C24H25N3O3
Mass
403.482
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
p-Toluamides Benzamides N-acylpyrrolidines Benzoyl derivatives Tertiary carboxylic acid amides Isoxazoles Heteroaromatic compounds Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzamide - Benzisoxazole - P-toluamide - Toluamide - Benzoic acid or derivatives - Benzoyl - N-acylpyrrolidine - Toluene - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Isoxazole - Pyrrolidine - Tertiary carboxylic acid amide - Carboxamide group - Secondary carboxylic acid amide - Oxacycle - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organic oxygen 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