Compound Identification
SMILES
CC1=C(CO)C=C2CN(CC(=O)C3=CC(=C(O)C(OCCCC(N)=O)=C3)C(C)(C)C)C(=N)C2=N1
InChIKey
InChIKey=HXNRIUQVGSJRRP-UHFFFAOYSA-N
Formula
C25H32N4O5
Mass
468.554
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
Pyrrolopyridines Phenylpropanes Aryl alkyl ketones Phenoxy compounds Phenol ethers Benzoyl derivatives Alkyl aryl ethers Phenols Methylpyridines Fatty amides Imidolactams Heteroaromatic compounds Primary carboxylic acid amides Carboximidamides Carboxamidines Azacyclic compounds Organic oxides Primary alcohols Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Phenylpropane - Pyrrolopyridine - Phenoxy compound - Benzoyl - Phenol ether - Aryl alkyl ketone - Alkyl aryl ether - Methylpyridine - Phenol - Monocyclic benzene moiety - Fatty amide - Pyridine - Fatty acyl - Benzenoid - Imidolactam - Heteroaromatic compound - Carboxamide group - Primary carboxylic acid amide - Organoheterocyclic compound - Carboximidamide - Carboxylic acid amidine - Amidine - Carboxylic acid derivative - Ether - Azacycle - Organic oxide - Aromatic alcohol - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Primary alcohol - Alcohol - 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