Compound Identification
SMILES
O=C1OC2=C(C=C1)C=CC(CNCCCNC1=CC=CC=C1)=C2
InChIKey
InChIKey=RCPINFKHJRIEQC-UHFFFAOYSA-N
Formula
C19H20N2O2
Mass
308.381
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarins and derivatives
Alternative Parents
1-benzopyrans Phenylalkylamines Aniline and substituted anilines Secondary alkylarylamines Pyranones and derivatives Heteroaromatic compounds Lactones Oxacyclic compounds Dialkylamines Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - Phenylalkylamine - Aniline or substituted anilines - Pyranone - Aralkylamine - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Pyran - Benzenoid - Heteroaromatic compound - Lactone - Organoheterocyclic compound - Oxacycle - Secondary aliphatic amine - Secondary amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one).
External Descriptors
Not available