Compound Identification
SMILES
NC1=C(C#N)[C@@H](C2=CC=CC=C2)C2=C(O1)C=C(C=C2)C(F)(F)F
InChIKey
InChIKey=HULIAUWUMOWLDY-HNNXBMFYSA-N
Formula
C17H11F3N2O
Mass
316.283
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
1-benzopyrans Benzene and substituted derivatives Ketene acetals Oxacyclic compounds Nitriles Organopnictogen compounds Organofluorides Monoalkylamines Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Neoflavonoid skeleton - Benzopyran - 1-benzopyran - Monocyclic benzene moiety - Benzenoid - Ketene acetal or derivatives - Carbonitrile - Nitrile - Oxacycle - Organoheterocyclic compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Primary aliphatic amine - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen 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