Compound Identification
SMILES
CC(=O)C1=CC=C(NCC(=O)N2CCN(CC2)C2=CC=C(Cl)C=C2)C=C1
InChIKey
InChIKey=JQVBSFIKLGXLHK-UHFFFAOYSA-N
Formula
C20H22ClN3O2
Mass
371.87
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
Phenylpiperazines Alpha amino acid amides N-arylpiperazines Acetophenones Phenylalkylamines Aniline and substituted anilines Aryl alkyl ketones Dialkylarylamines Benzoyl derivatives Secondary alkylarylamines Chlorobenzenes Aryl chlorides Tertiary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Alpha-amino acid amide - Phenylpiperazine - N-arylpiperazine - Alpha-amino acid or derivatives - Acetophenone - Benzoyl - Tertiary aliphatic/aromatic amine - Phenylalkylamine - Aryl alkyl ketone - Dialkylarylamine - Aniline or substituted anilines - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Tertiary carboxylic acid amide - Tertiary amine - Carboxamide group - Amino acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Secondary amine - Organohalogen compound - Organic nitrogen compound - Amine - Organochloride - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic 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