Compound Identification
SMILES
OC(=O)OC1(CN2CCC(COC3=NOC4=C3C(OCC(F)(F)F)=CC=C4)CC2)CCOCC1
InChIKey
InChIKey=ISZNJVHATKOYCJ-UHFFFAOYSA-N
Formula
C22H27F3N2O7
Mass
488.46
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
Phenol ethers Alkyl aryl ethers Piperidines Oxanes Carbonic acid monoesters Heteroaromatic compounds Isoxazoles Trialkylamines Azacyclic compounds Dialkyl ethers Oxacyclic compounds Hydrocarbon derivatives Alkyl fluorides Carbonyl compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzisoxazole - Phenol ether - Alkyl aryl ether - Oxane - Piperidine - Benzenoid - Azole - Carbonic acid monoester - Isoxazole - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Carbonic acid derivative - Azacycle - Oxacycle - Dialkyl ether - Ether - Amine - Organohalogen compound - Alkyl halide - Organofluoride - Organonitrogen compound - Carbonyl group - Alkyl fluoride - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - 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