Compound Identification
SMILES
ClC1=CC=CC=C1C1CC(=NN1)C1=CC2=CC=CC=C2OC1=O
InChIKey
InChIKey=NOSNEEQJMYUKIZ-UHFFFAOYSA-N
Formula
C18H13ClN2O2
Mass
324.76
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 Pyranones and derivatives Chlorobenzenes Aryl chlorides Pyrazolines Heteroaromatic compounds Lactones Oxacyclic compounds Hydrazones Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - Chlorobenzene - Halobenzene - Pyranone - Benzenoid - Pyran - Aryl halide - Monocyclic benzene moiety - Aryl chloride - Heteroaromatic compound - Pyrazoline - Lactone - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrazone - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organopnictogen compound - Hydrocarbon derivative - 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