Compound Identification
SMILES
[O-][N+](=O)C1=CC=CC(=C1)C(=O)C1C2(C3CCCN3C11C(=O)NC3=C1C=C(Cl)C=C3)C(=O)NC1=CC=CC=C21
InChIKey
InChIKey=RPTKCNLFCBXWBF-UHFFFAOYSA-N
Formula
C28H21ClN4O5
Mass
528.95
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
Alpha amino acid amides Indolines Nitrobenzenes Pyrrolizidines Aryl alkyl ketones Benzoyl derivatives Nitroaromatic compounds Aralkylamines Aryl chlorides Beta-amino ketones Gamma-amino ketones N-alkylpyrrolidines Lactams Secondary carboxylic acid amides Trialkylamines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic zwitterions Hydrocarbon derivatives Organochlorides Organic salts Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Alpha-amino acid amide - Alpha-amino acid or derivatives - Nitrobenzene - Dihydroindole - Indole or derivatives - Pyrrolizidine - Nitroaromatic compound - Aryl alkyl ketone - Benzoyl - Aralkylamine - N-alkylpyrrolidine - Gamma-aminoketone - Aryl halide - Aryl chloride - Beta-aminoketone - Benzenoid - Monocyclic benzene moiety - Pyrrolidine - Secondary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Organic nitro compound - Carboxamide group - Lactam - C-nitro compound - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic salt - Organic oxide - Organochloride - Amine - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organic zwitterion - 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