Compound Identification
SMILES
COC1=CC=CC=C1CN(CC(CC1=CNC2=CC=CC=C12)NC(=O)CCC(=O)C1=CC=CC=C1)C(C)=O
InChIKey
InChIKey=ZDEIAFJLFFATFK-UHFFFAOYSA-N
Formula
C31H33N3O4
Mass
511.622
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
Tryptamines and derivatives Butyrophenones 3-alkylindoles Phenoxy compounds Methoxybenzenes Benzoyl derivatives Aryl alkyl ketones Anisoles Alkyl aryl ethers Substituted pyrroles N-acyl amines Tertiary carboxylic acid amides Acetamides Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Triptan - Butyrophenone - 3-alkylindole - Indole or derivatives - Indole - Phenol ether - Phenoxy compound - Anisole - Aryl alkyl ketone - Methoxybenzene - Benzoyl - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Fatty acyl - Fatty amide - N-acyl-amine - Substituted pyrrole - Heteroaromatic compound - Acetamide - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Secondary carboxylic acid amide - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Azacycle - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - 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