Compound Identification
SMILES
C[C@@H](OC(=O)C1=CC=C(C=C1)N1N=CC=C1C)C(=O)NC1=CC=CC(=C1)C(C)=O
InChIKey
InChIKey=USHQDZKXVCODBK-MRXNPFEDSA-N
Formula
C22H21N3O4
Mass
391.427
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
Phenylpyrazoles Benzoic acid esters Anilides Acetophenones N-arylamides Benzoyl derivatives Aryl alkyl ketones Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Phenylpyrazole - Benzoate ester - Acetophenone - Benzoic acid or derivatives - Anilide - Benzoyl - N-arylamide - Aryl alkyl ketone - Benzenoid - Monocyclic benzene moiety - Pyrazole - Heteroaromatic compound - Azole - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - 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