Compound Identification
SMILES
CC1=NC(NC(=O)COC(=O)CCC(=O)C2=CC=CC=C2)=C(Cl)C=C1Cl
InChIKey
InChIKey=WCJJJTRHPIMLCB-UHFFFAOYSA-N
Formula
C18H16Cl2N2O4
Mass
395.24
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
Butyrophenones Aryl alkyl ketones Benzoyl derivatives Gamma-keto acids and derivatives N-arylamides Polyhalopyridines Methylpyridines Fatty acid esters Imidolactams Aryl chlorides Heteroaromatic compounds Carboxylic acid esters Secondary carboxylic acid amides Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - Benzoyl - Gamma-keto acid - N-arylamide - Polyhalopyridine - Aryl alkyl ketone - Methylpyridine - Fatty acid ester - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Keto acid - Pyridine - Benzenoid - Fatty acyl - Imidolactam - Heteroaromatic compound - Carboxylic acid ester - Secondary carboxylic acid amide - Carboxamide group - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen 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