Compound Identification
SMILES
CCC(N1N=CN(C1=O)C1=CN=C(C=C1)N1CCN(CC1)C1=CC(OC)=CC=C1)C(=O)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=RIUKGHVZMNVFEK-UHFFFAOYSA-N
Formula
C28H29ClN6O3
Mass
533.03
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
Pyridinylpiperazines Phenylpiperazines N-arylpiperazines Pyridyltriazoles Butyrophenones Aminophenyl ethers Methoxyanilines Anisoles Phenoxy compounds Aryl alkyl ketones Methoxybenzenes Benzoyl derivatives Dialkylarylamines Alkyl aryl ethers Aminopyridines and derivatives Chlorobenzenes Imidolactams Aryl chlorides Triazoles Heteroaromatic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Phenylpiperazine - Pyridinylpiperazine - N-arylpiperazine - Butyrophenone - Pyridyltriazole - Aminophenyl ether - Methoxyaniline - Anisole - Benzoyl - Phenol ether - Phenoxy compound - Tertiary aliphatic/aromatic amine - Aryl alkyl ketone - Dialkylarylamine - Aniline or substituted anilines - Methoxybenzene - Chlorobenzene - Halobenzene - Aminopyridine - Alkyl aryl ether - Monocyclic benzene moiety - Aryl halide - Imidolactam - Aryl chloride - Benzenoid - 1,4-diazinane - Piperazine - Pyridine - 1,2,4-triazole - Azole - Heteroaromatic compound - Triazole - Tertiary amine - Ether - Azacycle - Organoheterocyclic compound - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organochloride - Organonitrogen compound - 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