Compound Identification
SMILES
C\C=C\CN1C(=NC2=C1C(=O)N(CC(=O)C1=CC=CC=C1NC(=O)C1CC1)C(=O)N2C)N1CCCC(N)C1
InChIKey
InChIKey=CKODAJMPQKFANJ-ONEGZZNKSA-N
Formula
C27H33N7O4
Mass
519.606
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
Xanthines 6-oxopurines Alkaloids and derivatives Anilides Aryl alkyl ketones N-arylamides Benzoyl derivatives Dialkylarylamines Aminopiperidines Pyrimidones Aminoimidazoles N-substituted imidazoles Cyclopropanecarboxylic acids and derivatives Vinylogous amides Heteroaromatic compounds Amino acids and derivatives Ureas Secondary carboxylic acid amides Lactams Azacyclic compounds Monoalkylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Xanthine - 6-oxopurine - Purinone - Purine - Imidazopyrimidine - Alkaloid or derivatives - Anilide - N-arylamide - Aryl alkyl ketone - Benzoyl - Dialkylarylamine - 3-aminopiperidine - Pyrimidone - Benzenoid - Aminoimidazole - Monocyclic benzene moiety - N-substituted imidazole - Piperidine - Pyrimidine - Cyclopropanecarboxylic acid or derivatives - Azole - Heteroaromatic compound - Imidazole - Vinylogous amide - Lactam - Amino acid or derivatives - Carboxamide group - Urea - Secondary carboxylic acid amide - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Primary aliphatic amine - Organic oxide - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Primary amine - 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