Compound Identification
SMILES
FC1=CC=C(C=C1)C(=O)CCCN1N=C2CN=C(C3=CC=CC=C3F)C3=CC=CC=C3N2C(=O)C1=O
InChIKey
InChIKey=VYIVFEUMYNRXLZ-UHFFFAOYSA-N
Formula
C27H20F2N4O3
Mass
486.479
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
Phenylbutylamines 1,4-benzodiazepines Butyrophenones Aryl alkyl ketones Benzoyl derivatives Fluorobenzenes 1,2,4-triazines Aryl fluorides Heteroaromatic compounds Lactams Ketimines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Benzodiazepine - Butyrophenone - Phenylbutylamine - 1,4-benzodiazepine - Benzoyl - Aryl alkyl ketone - Fluorobenzene - Halobenzene - 1,2,4-triazine - Monocyclic benzene moiety - Aryl fluoride - Benzenoid - Triazine - Aryl halide - Heteroaromatic compound - Ketimine - Lactam - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Imine - Organofluoride - 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