Compound Identification
SMILES
CCC(CC)OC1=CC(=CC2=C1O[C@H]1CCNC[C@@H]21)C1=C(F)C=C(Cl)C=C1F
InChIKey
InChIKey=WHKLMMIGDHYDRW-LPHOPBHVSA-N
Formula
C22H24ClF2NO2
Mass
407.89
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Coumarans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Coumarans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarans
Alternative Parents
Phenol ethers Fluorobenzenes Chlorobenzenes Aralkylamines Alkyl aryl ethers Piperidines Aryl fluorides Aryl chlorides Oxacyclic compounds Dialkylamines Azacyclic compounds Organofluorides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumaran - Phenol ether - Alkyl aryl ether - Chlorobenzene - Fluorobenzene - Halobenzene - Aralkylamine - Benzenoid - Piperidine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Aryl chloride - Secondary amine - Oxacycle - Azacycle - Secondary aliphatic amine - Ether - Organic oxygen compound - Organohalogen compound - Amine - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarans. These are compounds containing the coumaran skeleton, which consists of a benzene ring fused to a 2,3-dihydrofuran ring.
External Descriptors
Not available