Compound Identification
SMILES
CC1=C(C=C(C=C1)C(=O)NC1=CC(=NC=C1)N1CCCC1)C1=CC2=C(C=C1)C(=NO2)C1CCNCC1
InChIKey
InChIKey=XCBIXMKSOYTTJH-UHFFFAOYSA-N
Formula
C29H31N5O2
Mass
481.6
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 Dialkylarylamines Benzoyl derivatives Aminopyridines and derivatives Aralkylamines Piperidines Imidolactams Pyrrolidines Isoxazoles Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Oxacyclic compounds Dialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzamide - Benzisoxazole - Benzoic acid or derivatives - P-toluamide - Toluamide - Benzoyl - Dialkylarylamine - Aminopyridine - Aralkylamine - Toluene - Monocyclic benzene moiety - Piperidine - Imidolactam - Benzenoid - Pyridine - Azole - Isoxazole - Heteroaromatic compound - Pyrrolidine - Carboxamide group - Amino acid or derivatives - Secondary carboxylic acid amide - Azacycle - Oxacycle - Secondary aliphatic amine - Carboxylic acid derivative - Secondary amine - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Amine - Organonitrogen 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