Compound Identification
SMILES
Cl.N=C(CC1=NOC2=CC=CC=C12)N1CCN(CC2=CC=CC=C2)CC1
InChIKey
InChIKey=MOZLHQFPZPCFMK-UHFFFAOYSA-N
Formula
C20H23ClN4O
Mass
370.88
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
Phenylmethylamines Benzylamines N-alkylpiperazines Aralkylamines Isoxazoles Heteroaromatic compounds Trialkylamines Oxacyclic compounds Carboximidamides Carboxamidines Azacyclic compounds Organooxygen compounds Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzisoxazole - Benzylamine - Phenylmethylamine - N-alkylpiperazine - Aralkylamine - Benzenoid - Piperazine - Monocyclic benzene moiety - 1,4-diazinane - Heteroaromatic compound - Azole - Isoxazole - Tertiary aliphatic amine - Tertiary amine - Azacycle - Oxacycle - Amidine - Carboximidamide - Carboxylic acid amidine - Hydrochloride - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - 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