Compound Identification
SMILES
COC1=CC(C(=O)C2=CN(C(=O)C(=C2)C#N)C2=C(Cl)C=CC(=C2)C(F)(F)F)=C(O)C=C1
InChIKey
InChIKey=BUZRZLMQVHVYOM-UHFFFAOYSA-N
Formula
C21H12ClF3N2O4
Mass
448.78
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Aryl-phenylketones
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Level 7
Phenylketones
-
Level 6
Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Aryl ketones - Phenylketones
Direct Parent
Aryl-phenylketones
Alternative Parents
Methoxyphenols Trifluoromethylbenzenes 4-alkoxyphenols Pyridinecarboxylic acids and derivatives Phenoxy compounds 3-pyridinecarbonitriles Benzoyl derivatives Methoxybenzenes Anisoles Chlorobenzenes 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Dihydropyridines Pyridinones Aryl chlorides Vinylogous amides Heteroaromatic compounds Vinylogous acids Lactams Nitriles Azacyclic compounds Hydrocarbon derivatives Organofluorides Alkyl fluorides Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - Methoxyphenol - Trifluoromethylbenzene - 4-alkoxyphenol - Pyridine carboxylic acid or derivatives - Phenoxy compound - Phenol ether - Anisole - Benzoyl - 3-pyridinecarbonitrile - Methoxybenzene - Alkyl aryl ether - Halobenzene - Dihydropyridine - Chlorobenzene - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Pyridinone - Pyridine - Aryl chloride - Hydropyridine - Benzenoid - Aryl halide - Monocyclic benzene moiety - Vinylogous acid - Vinylogous amide - Heteroaromatic compound - Lactam - Azacycle - Organoheterocyclic compound - Ether - Nitrile - Carbonitrile - Organofluoride - Organonitrogen compound - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Alkyl halide - Organochloride - Organohalogen compound - Cyanide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.
External Descriptors
Not available