Compound Identification
SMILES
COC1=CC(OC)=C(C=C1)C1C(C#N)C(=N)OC2=C1C=CC(=C2)N(C)C
InChIKey
InChIKey=IRDGLSYSNHRAHK-UHFFFAOYSA-N
Formula
C20H21N3O3
Mass
351.406
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Neoflavonoids
- Subclass Neoflavans
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Class
Neoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Neoflavonoids
Subclass
Neoflavans
Intermediate Tree Nodes
Not available
Direct Parent
Neoflavans
Alternative Parents
Dimethoxybenzenes 1-benzopyrans Phenoxy compounds Dialkylarylamines Anisoles Alkyl aryl ethers Imidoesters Oxacyclic compounds Nitriles Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Neoflavan - Chromane - Benzopyran - 1-benzopyran - Dimethoxybenzene - M-dimethoxybenzene - Anisole - Phenoxy compound - Phenol ether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Tertiary amine - Imido ester - Oxacycle - Organoheterocyclic compound - Nitrile - Carbonitrile - Ether - Organic nitrogen compound - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Cyanide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as neoflavans. These are neoflavonoids with a structure based on a 3,4-dihydro-4-aryl-2H-1-benzopyran skeleton.
External Descriptors
Not available