Compound Identification
SMILES
FC1=CC(F)=C(C=C1)C(=O)CCC1=CC=C(NC2=NCCN2)C=C1
InChIKey
InChIKey=VWVSXLXCFBCNTF-UHFFFAOYSA-N
Formula
C18H17F2N3O
Mass
329.351
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
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Subclass
Chalcones and dihydrochalcones
- Level 5 Retro-dihydrochalcones
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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
Retro-dihydrochalcones
Alternative Parents
Alkyl-phenylketones Butyrophenones Aniline and substituted anilines Aryl alkyl ketones Benzoyl derivatives Fluorobenzenes Aryl fluorides Vinylogous halides Imidazolines Guanidines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Carboximidamides Hydrocarbon derivatives Amines Organic oxides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Retro-dihydrochalcone - Alkyl-phenylketone - Butyrophenone - Phenylketone - Aryl ketone - Aryl alkyl ketone - Benzoyl - Aniline or substituted anilines - Halobenzene - Fluorobenzene - Monocyclic benzene moiety - Aryl halide - Benzenoid - Aryl fluoride - Vinylogous halide - 2-imidazoline - Guanidine - Ketone - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as retro-dihydrochalcones. These are a form of normal dihydrochalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.
External Descriptors
Not available