Compound Identification
SMILES
Cl.Cl.CCCC(=O)C1=CC=C(C=C1)C1=CC2=CC=CC=C2C(=N1)N1CCN(CC)CC1
InChIKey
InChIKey=WQRUMBVARKEKRF-UHFFFAOYSA-N
Formula
C25H31Cl2N3O
Mass
460.44
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
N-arylpiperazines Pyridinylpiperazines Phenylpyridines Butyrophenones Isoquinolines and derivatives Dialkylarylamines Benzoyl derivatives Aryl alkyl ketones N-alkylpiperazines Aminopyridines and derivatives Imidolactams Heteroaromatic compounds Trialkylamines Azacyclic compounds Hydrochlorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - 2-phenylpyridine - Pyridinylpiperazine - N-arylpiperazine - Butyrophenone - Isoquinoline - Benzoyl - Aryl alkyl ketone - Dialkylarylamine - N-alkylpiperazine - Aminopyridine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Pyridine - Imidolactam - Benzenoid - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Organoheterocyclic compound - Azacycle - Hydrochloride - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Amine - Organic nitrogen compound - 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