Compound Identification
SMILES
O[NH+]([O-])C1=C(NC(=O)C(=O)C(C2OC(=O)C3=CC=CC=C23)C(=O)C2=CC3=CC=CC=C3C=C2)C=CC(=C1)C(F)(F)F
InChIKey
InChIKey=LQPSSTPHLGEHSB-UHFFFAOYSA-N
Formula
C29H19F3N2O7
Mass
564.473
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Butyrophenones
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Butyrophenones
Intermediate Tree Nodes
Not available
Direct Parent
Butyrophenones
Alternative Parents
Trifluoromethylbenzenes Phthalides Benzofuranones Naphthalenes Anilides Aryl alkyl ketones N-arylamides Beta-diketones Fatty amides Secondary carboxylic acid amides Carboxylic acid esters Lactones Oxacyclic compounds N-organohydroxylamines Organic oxides Organic salts Organic zwitterions Organofluorides Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Butyrophenone - Benzofuranone - Trifluoromethylbenzene - Naphthalene - Isobenzofuranone - Phthalide - Isocoumaran - Anilide - N-arylamide - Aryl ketone - Aryl alkyl ketone - 1,3-diketone - Fatty acyl - 1,3-dicarbonyl compound - Fatty amide - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid ester - Ketone - Lactone - Organoheterocyclic compound - N-organohydroxylamine - Oxacycle - Carboxylic acid derivative - Organic salt - Organohalogen compound - Organic oxide - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Alkyl fluoride - Organic zwitterion - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as butyrophenones. These are compounds containing 1-phenylbutan-1-one moiety.
External Descriptors
Not available