Compound Identification
SMILES
CCN(C1CCCCC1)C1=CC(=CC2=C1O[C@H]1CCNC[C@@H]21)C1=C(Cl)C=C(Cl)C=C1
InChIKey
InChIKey=IMXYOZRDKNOBTD-URXFXBBRSA-N
Formula
C25H30Cl2N2O
Mass
445.43
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
Dichlorobenzenes Dialkylarylamines Cyclohexylamines Aralkylamines Alkyl aryl ethers Piperidines Aryl chlorides Oxacyclic compounds Dialkylamines Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumaran - 1,3-dichlorobenzene - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Alkyl aryl ether - Chlorobenzene - Cyclohexylamine - Halobenzene - Aralkylamine - Aryl halide - Benzenoid - Piperidine - Monocyclic benzene moiety - Aryl chloride - Tertiary amine - Oxacycle - Azacycle - Secondary amine - Secondary aliphatic amine - Ether - Organic oxygen compound - Amine - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organohalogen compound - Organochloride - 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