Compound Identification
SMILES
FC(F)(F)C1=CC=C(C=C1)C(=O)CN1CCN(CC1)C(=O)C1=CC=CN2C=CN=C12
InChIKey
InChIKey=BBFQNJGJAFYLPB-UHFFFAOYSA-N
Formula
C21H19F3N4O2
Mass
416.404
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
Trifluoromethylbenzenes Pyridinecarboxylic acids and derivatives Imidazopyridines Imidazo[1,2-a]pyridines Aryl alkyl ketones Benzoyl derivatives N-alkylpiperazines N-substituted imidazoles Vinylogous amides Tertiary carboxylic acid amides Alpha-amino ketones Heteroaromatic compounds Trialkylamines Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Trifluoromethylbenzene - Imidazo[1,2-a]pyridine - Imidazopyridine - Pyridine carboxylic acid or derivatives - Benzoyl - Aryl alkyl ketone - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - N-substituted imidazole - Piperazine - Benzenoid - Pyridine - Alpha-aminoketone - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Tertiary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organofluoride - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Alkyl halide - Organonitrogen compound - Alkyl fluoride - Amine - Organohalogen compound - Aromatic heteropolycyclic 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