Compound Identification
SMILES
FC(F)(F)C1=CC(Cl)=C(NN=C2CC(OC3=CC=CC=C23)C2=CC=CC=C2)N=C1
InChIKey
InChIKey=YGLLSZFXDCTGHS-UHFFFAOYSA-N
Formula
C21H15ClF3N3O
Mass
417.82
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
- Subclass Flavans
-
Class
Flavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavans
Intermediate Tree Nodes
Not available
Direct Parent
Flavans
Alternative Parents
1-benzopyrans Alkyl aryl ethers Pyridines and derivatives Imidolactams Benzene and substituted derivatives Aryl chlorides Heteroaromatic compounds Oxacyclic compounds Hydrazones Azacyclic compounds Organopnictogen compounds Organofluorides Organochlorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flavan - Chromane - Benzopyran - 1-benzopyran - Alkyl aryl ether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyridine - Heteroaromatic compound - Oxacycle - Azacycle - Ether - Organoheterocyclic compound - Hydrazone - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavans. These are compounds containing a flavan moiety, with a structure characterized by a 2-phenyl-3,4-dihydro-2H-1-benzopyran skeleton.
External Descriptors
Not available