Compound Identification
SMILES
CCN(CC)C1=CC(=CC2=C1OC1CCNCC21)C1=C(Cl)C=C(Cl)C=C1Cl
InChIKey
InChIKey=SMXJQGDOJAHGAF-UHFFFAOYSA-N
Formula
C21H23Cl3N2O
Mass
425.78
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
Dialkylarylamines Chlorobenzenes Aralkylamines Alkyl aryl ethers Piperidines Aryl chlorides Oxacyclic compounds Dialkylamines Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumaran - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aralkylamine - Aryl chloride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Piperidine - Tertiary amine - Oxacycle - Azacycle - Secondary amine - Secondary aliphatic amine - Ether - Organic nitrogen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - 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