Compound Identification
SMILES
CN1C=NC=C1C(O)(C1=CC=C(C=C1)C(F)(F)F)C1=CC2=C(C=C1)N(C)C(=O)C=C2C1=CC(Cl)=CC=C1
InChIKey
InChIKey=BYVMEYUKUWRETI-UHFFFAOYSA-N
Formula
C28H21ClF3N3O2
Mass
523.94
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
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Class
Diarylheptanoids
- Subclass Linear diarylheptanoids
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Class
Diarylheptanoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Diarylheptanoids
Subclass
Linear diarylheptanoids
Intermediate Tree Nodes
Not available
Direct Parent
Linear diarylheptanoids
Alternative Parents
Phenylquinolines Phenylpyridines Hydroquinolones Trifluoromethylbenzenes Hydroquinolines Chlorobenzenes Pyridinones Aryl chlorides N-substituted imidazoles Heteroaromatic compounds Tertiary alcohols Lactams Azacyclic compounds Aromatic alcohols Organofluorides Organonitrogen compounds Hydrocarbon derivatives Alkyl fluorides Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Phenylquinoline - 4-phenylpyridine - Dihydroquinolone - Dihydroquinoline - Trifluoromethylbenzene - Quinoline - Chlorobenzene - Pyridinone - Halobenzene - Benzenoid - Pyridine - N-substituted imidazole - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Tertiary alcohol - Azole - Imidazole - Heteroaromatic compound - Lactam - Organoheterocyclic compound - Azacycle - Alcohol - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.
External Descriptors
Not available