Compound Identification
SMILES
COC1=CC=CC(=C1F)C1=C(C)C(CC2=C(F)C=CC=C2F)=C2SCC(N2C1=O)C(=O)C1=C(F)C=CC(F)=C1
InChIKey
InChIKey=IAYLQFBBJMYUQW-UHFFFAOYSA-N
Formula
C29H20F5NO3S
Mass
557.54
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
Phenylpyridines Phenoxy compounds Anisoles Methoxybenzenes Aryl alkyl ketones Benzoyl derivatives Pyridinones Alkyl aryl ethers Alkylarylthioethers Methylpyridines Fluorobenzenes Aryl fluorides Vinylogous halides Heteroaromatic compounds Lactams Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - 3-phenylpyridine - Anisole - Phenoxy compound - Aryl thioether - Benzoyl - Phenol ether - Aryl alkyl ketone - Methoxybenzene - Alkyl aryl ether - Fluorobenzene - Halobenzene - Methylpyridine - Pyridinone - Alkylarylthioether - Aryl halide - Pyridine - Aryl fluoride - Monocyclic benzene moiety - Benzenoid - Vinylogous halide - Heteroaromatic compound - Lactam - Thioether - Azacycle - Organoheterocyclic compound - Ether - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen 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