Compound Identification
SMILES
CCCN1C=C(C=C(C#N)C1=O)C(=O)C1=C(O)C=CC(F)=C1
InChIKey
InChIKey=DAANZFZSABSQKF-UHFFFAOYSA-N
Formula
C16H13FN2O3
Mass
300.289
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
-
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
Pyridinecarboxylic acids and derivatives 3-pyridinecarbonitriles Benzoyl derivatives P-fluorophenols Fluorobenzenes Dihydropyridines 1-hydroxy-2-unsubstituted benzenoids Pyridinones Aryl fluorides Heteroaromatic compounds Vinylogous amides Vinylogous acids Lactams Nitriles Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - Pyridine carboxylic acid or derivatives - Benzoyl - 4-halophenol - 4-fluorophenol - 3-pyridinecarbonitrile - 1-hydroxy-2-unsubstituted benzenoid - Dihydropyridine - Fluorobenzene - Halobenzene - Phenol - Pyridinone - Monocyclic benzene moiety - Aryl fluoride - Hydropyridine - Aryl halide - Pyridine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Vinylogous acid - Lactam - Nitrile - Carbonitrile - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Cyanide - Hydrocarbon derivative - Organic nitrogen compound - 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