Compound Identification
SMILES
NC1=CC(OC2=CC=C(\C=C\C(=O)C3=CC=CC=C3)C=C2)=CC(N)=C1
InChIKey
InChIKey=LWEYXJQIXBWGHG-DHZHZOJOSA-N
Formula
C21H18N2O2
Mass
330.387
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
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Subclass
Chalcones and dihydrochalcones
- Level 5 Retrochalcones
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Subclass
Chalcones and dihydrochalcones
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Class
Linear 1,3-diarylpropanoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Linear 1,3-diarylpropanoids
Subclass
Chalcones and dihydrochalcones
Intermediate Tree Nodes
Not available
Direct Parent
Retrochalcones
Alternative Parents
Diphenylethers Cinnamic acids and derivatives Diarylethers Styrenes Phenoxy compounds Phenol ethers Benzoyl derivatives Aryl ketones Aniline and substituted anilines Enones Acryloyl compounds Primary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Retrochalcone - Diphenylether - Cinnamic acid or derivatives - Diaryl ether - Benzoyl - Phenoxy compound - Phenol ether - Styrene - Aryl ketone - Aniline or substituted anilines - Monocyclic benzene moiety - Benzenoid - Enone - Acryloyl-group - Alpha,beta-unsaturated ketone - Ketone - Ether - Organic oxygen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as retrochalcones. These are a form of normal chalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.
External Descriptors
Not available