Compound Identification
SMILES
CC1=CC(C(=O)COC(=O)CCC(=O)C2=CC=C(F)C=C2)=C(C)N1C1=CC(C)=C(C)C=C1
InChIKey
InChIKey=KTVSFDGDHUWBNL-UHFFFAOYSA-N
Formula
C26H26FNO4
Mass
435.495
Taxonomic Classification
Taxonomy Tree
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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
Butyrophenones Phenylpyrroles Aryl alkyl ketones Benzoyl derivatives o-Xylenes Gamma-keto acids and derivatives Fluorobenzenes Fatty acid esters Alpha-acyloxy ketones Aryl fluorides Heteroaromatic compounds Vinylogous amides Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - 1-phenylpyrrole - Benzoyl - O-xylene - Xylene - Gamma-keto acid - Aryl alkyl ketone - Fatty acid ester - Fluorobenzene - Halobenzene - Alpha-acyloxy ketone - Benzenoid - Substituted pyrrole - Fatty acyl - Keto acid - Aryl halide - Monocyclic benzene moiety - Aryl fluoride - Pyrrole - Heteroaromatic compound - Vinylogous amide - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organofluoride - 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