Compound Identification
SMILES
OCC(=O)C1=CC=C(C=C1)C1=CC(CC(O)(C2CCOCC2)C(=O)NC2=CC(=C(C=C2)C#N)C(F)(F)F)=CC=C1
InChIKey
InChIKey=YBYCZKOQIFUARJ-UHFFFAOYSA-N
Formula
C30H27F3N2O5
Mass
552.55
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 Alkyl-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
Alkyl-phenylketones
Alternative Parents
Biphenyls and derivatives Trifluoromethylbenzenes Anilides Aryl alkyl ketones Benzonitriles Benzoyl derivatives N-arylamides Fatty amides Oxanes Tertiary alcohols Alpha-hydroxy ketones Secondary carboxylic acid amides Nitriles Dialkyl ethers Oxacyclic compounds Organic oxides Alkyl fluorides Hydrocarbon derivatives Organofluorides Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Biphenyl - Trifluoromethylbenzene - Anilide - Benzonitrile - Benzoyl - Aryl alkyl ketone - N-arylamide - Monocyclic benzene moiety - Fatty acyl - Fatty amide - Benzenoid - Oxane - Alpha-hydroxy ketone - Tertiary alcohol - Carboxamide group - Secondary carboxylic acid amide - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Nitrile - Carbonitrile - Organoheterocyclic compound - Ether - Primary alcohol - Organohalogen compound - Organofluoride - Alcohol - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available