Compound Identification
SMILES
CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)CC(O)=O
InChIKey
InChIKey=FVLKECILNZIVTM-UHFFFAOYSA-N
Formula
C25H41NO3
Mass
403.607
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
Phenylpropanoic acids Phenylalkylamines Benzoyl derivatives Aryl alkyl ketones Aniline and substituted anilines Secondary alkylarylamines Beta-keto acids and derivatives Beta-hydroxy ketones 1,3-dicarbonyl compounds Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - 3-phenylpropanoic-acid - Benzoyl - Aryl alkyl ketone - Aniline or substituted anilines - Phenylalkylamine - Beta-keto acid - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Beta-hydroxy ketone - Keto acid - 1,3-dicarbonyl compound - Benzenoid - Amino acid - Amino acid or derivatives - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Secondary amine - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Amine - Aromatic homomonocyclic 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