Compound Identification
SMILES
COC(=O)C1=CC=C(\C=N/NC(=O)C[NH+]2CCN(CC3=CC=C(Cl)C=C3)CC2)C=C1
InChIKey
InChIKey=PMBWZHJFVPJYQC-OYKKKHCWSA-O
Formula
C22H26ClN4O3
Mass
429.92
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
-
Subclass
Piperazines
- Level 5 N-piperazineacetamides
-
Subclass
Piperazines
-
Class
Diazinanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Not available
Direct Parent
N-piperazineacetamides
Alternative Parents
Alpha amino acids and derivatives Benzoic acid esters Phenylmethylamines Benzylamines Benzoyl derivatives Aralkylamines N-alkylpiperazines Chlorobenzenes Aryl chlorides Quaternary ammonium salts Methyl esters Trialkylamines Azacyclic compounds Organochlorides Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzoate ester - N-piperazineacetamide - Benzoic acid or derivatives - Benzoyl - Benzylamine - Phenylmethylamine - Chlorobenzene - Halobenzene - Aralkylamine - N-alkylpiperazine - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Quaternary ammonium salt - Methyl ester - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-piperazineacetamides. These are heterocyclic compounds containing a piperazine ring, which N-substituted with an acetamide group.
External Descriptors
Not available