Compound Identification
SMILES
COC1=CC(F)=C(C=C1)C(=O)\C=C\C1=C(C=CC(=C1)C1=CC=C(F)C=C1)N1CCN(C)CC1
InChIKey
InChIKey=LYGNWIICKYWXIB-WUXMJOGZSA-N
Formula
C27H26F2N2O2
Mass
448.514
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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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
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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
Biphenyls and derivatives Cinnamic acids and derivatives N-arylpiperazines Phenylpiperazines Aryl ketones Anisoles Benzoyl derivatives Dialkylarylamines Aniline and substituted anilines Methoxybenzenes Styrenes Phenoxy compounds Fluorobenzenes N-methylpiperazines Alkyl aryl ethers Aryl fluorides Vinylogous halides Acryloyl compounds Enones Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Retrochalcone - N-arylpiperazine - Phenylpiperazine - Cinnamic acid or derivatives - Biphenyl - Methoxybenzene - Aniline or substituted anilines - Dialkylarylamine - Phenol ether - Aryl ketone - Styrene - Tertiary aliphatic/aromatic amine - Benzoyl - Anisole - Phenoxy compound - N-methylpiperazine - Fluorobenzene - Halobenzene - Alkyl aryl ether - N-alkylpiperazine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Benzenoid - Piperazine - Acryloyl-group - Vinylogous halide - Alpha,beta-unsaturated ketone - Enone - Tertiary amine - Tertiary aliphatic amine - Ketone - Organoheterocyclic compound - Azacycle - Ether - Hydrocarbon derivative - Organic oxide - Amine - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organic oxygen compound - Organohalogen compound - Aromatic heteromonocyclic 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