Compound Identification
SMILES
CC1=CC=CC(=C1)[C@@H]1C2=C(OC(N)=C1C#N)C1=CC=CC=C1C=C2
InChIKey
InChIKey=JCLJWEKBWLMTPU-LJQANCHMSA-N
Formula
C21H16N2O
Mass
312.372
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Neoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Neoflavonoids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Neoflavonoids
Alternative Parents
Naphthopyrans Naphthalenes 1-benzopyrans Toluenes Pyrans Ketene acetals Oxacyclic compounds Nitriles Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Neoflavonoid skeleton - Naphthopyran - Benzopyran - Naphthalene - 1-benzopyran - Toluene - Monocyclic benzene moiety - Benzenoid - Pyran - Ketene acetal or derivatives - Oxacycle - Organoheterocyclic compound - Carbonitrile - Nitrile - Amine - Hydrocarbon derivative - Cyanide - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as neoflavonoids. These are compounds with a structure based on the 4-phenylchromene backbone.
External Descriptors
Not available