Compound Identification
SMILES
O=C(C1C(N(CCC2=CNC3=CC=CC=C23)C(=O)C1=O)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=CNXREZABIMPGTR-UHFFFAOYSA-N
Formula
C27H22N2O3
Mass
422.484
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
Phenylpyrrolidines 3-alkylindoles Aryl alkyl ketones Benzoyl derivatives Beta-diketones N-alkylpyrrolidines Pyrrolidine-3-ones Substituted pyrroles Pyrrolidine-2-ones Heteroaromatic compounds Tertiary carboxylic acid amides Lactams Cyclic ketones Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - 2-phenylpyrrolidine - 3-alkylindole - Indole - Indole or derivatives - Benzoyl - Aryl alkyl ketone - 1,3-diketone - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - Benzenoid - 3-pyrrolidone - N-alkylpyrrolidine - 1,3-dicarbonyl compound - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Pyrrolidine - Tertiary carboxylic acid amide - Lactam - Cyclic ketone - Carboxamide group - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organopnictogen compound - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - 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