Compound Identification
SMILES
FC(F)(F)C1=NC=CC(OCC2CN(CCO2)C(=O)CCC2=CC3=C(OCO3)C=C2)=N1
InChIKey
InChIKey=LGDJBAQAEITWSV-UHFFFAOYSA-N
Formula
C20H20F3N3O5
Mass
439.391
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodioxoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodioxoles
Alternative Parents
Alkyl aryl ethers Pyrimidines and pyrimidine derivatives Benzenoids Morpholines Tertiary carboxylic acid amides Heteroaromatic compounds Oxacyclic compounds Acetals Azacyclic compounds Dialkyl ethers Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides Alkyl fluorides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Alkyl aryl ether - Morpholine - Oxazinane - Pyrimidine - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Acetal - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Azacycle - Organohalogen compound - Organic oxide - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Organopnictogen compound - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
External Descriptors
Not available