Compound Identification
SMILES
COC1=C(NC=C1)\C=C1/C(=O)NC2=C1C1=C(NC(NCC3=CC=C(C=C3)C(C)=O)=N1)C=C2
InChIKey
InChIKey=VRBUZMOQNMUJAH-WJDWOHSUSA-N
Formula
C24H21N5O3
Mass
427.464
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
Acetophenones Benzimidazoles Indolines Aryl alkyl ketones Benzoyl derivatives Benzylamines Alkyl aryl ethers Substituted pyrroles Aminoimidazoles Heteroaromatic compounds Secondary carboxylic acid amides Lactams Azacyclic compounds Amines Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Acetophenone - Benzimidazole - Indole or derivatives - Dihydroindole - Aryl alkyl ketone - Benzoyl - Benzylamine - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Substituted pyrrole - Aminoimidazole - Heteroaromatic compound - Azole - Pyrrole - Imidazole - Carboxamide group - Secondary carboxylic acid amide - Lactam - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Amine - 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