Compound Identification
SMILES
CC(C)CC1=CC=C(C=C1)C(=O)CCC(=O)NC[C@H]1CN(C(=O)O1)C1=CC(F)=C(C=C1)N1N=NC2=CC=CC=C12
InChIKey
InChIKey=UMISVONWMWXONU-QHCPKHFHSA-N
Formula
C30H30FN5O4
Mass
543.599
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
Phenyl-1,2,3-triazoles Butyrophenones Phenylpropanes Benzotriazoles Aryl alkyl ketones Benzoyl derivatives Fluorobenzenes Oxazolidinones Aryl fluorides N-acyl amines Heteroaromatic compounds Carbamate esters Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - Phenyltriazole - Phenyl-1,2,3-triazole - Benzotriazole - Phenylpropane - Benzoyl - Aryl alkyl ketone - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Oxazolidinone - Fatty acyl - Benzenoid - Carbamic acid ester - Oxazolidine - 1,2,3-triazole - Triazole - Azole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Oxacycle - Organohalogen compound - Organofluoride - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen 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