Compound Identification
SMILES
CCCC1=C(OCC2=CN3C(=O)C(CCC4=NNN=N4)=CN=C3C=C2C)C=CC(C(C)=O)=C1O
InChIKey
InChIKey=OIZLACZCLMOKCO-UHFFFAOYSA-N
Formula
C24H26N6O4
Mass
462.51
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
Pyridopyrimidines Acetophenones Phenylpropanes Aryl alkyl ketones Benzoyl derivatives Phenoxy compounds Phenol ethers 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Pyrimidones Methylpyridines Heteroaromatic compounds Vinylogous acids Tetrazoles Lactams Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Pyridopyrimidine - Acetophenone - Phenylpropane - Phenoxy compound - Aryl alkyl ketone - Phenol ether - Benzoyl - Pyrimidone - Phenol - 1-hydroxy-4-unsubstituted benzenoid - Methylpyridine - Alkyl aryl ether - Pyrimidine - Benzenoid - Pyridine - Monocyclic benzene moiety - Azole - Heteroaromatic compound - Vinylogous acid - Tetrazole - Lactam - Ether - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - 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