Compound Identification
SMILES
CN(CCCN1C(=N)N(CC(=O)C2=CC=C(Cl)C=C2)C2=C1C(Cl)=CC=C2)C(=O)C1=CC=CC=C1Cl
InChIKey
InChIKey=DAKLIMFNZBRVRD-UHFFFAOYSA-N
Formula
C26H23Cl3N4O2
Mass
529.85
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
-
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
2-halobenzoic acids and derivatives Benzimidazoles Benzamides Aryl alkyl ketones Benzoyl derivatives Chlorobenzenes N-substituted imidazoles Aryl chlorides Vinylogous halides Tertiary carboxylic acid amides Heteroaromatic compounds Tertiary amines Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzimidazole - Benzoic acid or derivatives - Benzoyl - Aryl alkyl ketone - Chlorobenzene - Halobenzene - Monocyclic benzene moiety - Benzenoid - Aryl halide - N-substituted imidazole - Aryl chloride - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Imidazole - Vinylogous halide - Amino acid or derivatives - Carboxamide group - Tertiary amine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organohalogen compound - Organochloride - 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