Compound Identification
SMILES
CCOC(=O)C1=NN(C(N(N1C)C(C)=O)C1=CC=C(C)C=C1)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=ADAGQZFKWSSCLU-UHFFFAOYSA-N
Formula
C21H23ClN4O3
Mass
414.89
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Toluenes Chlorobenzenes Aryl chlorides Imidolactams Acetamides Amidrazones Carboxylic acid esters Carboxylic acid hydrazides Amidines Azacyclic compounds Monocarboxylic acids and derivatives Hydrazones Organopnictogen compounds Carbonyl compounds Organochlorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Halobenzene - Chlorobenzene - Toluene - Monocyclic benzene moiety - Aryl chloride - Benzenoid - Imidolactam - Aryl halide - Acetamide - Carboxylic acid ester - Carboxylic acid amidrazone - Carboxylic acid hydrazide - Monocarboxylic acid or derivatives - Hydrazone - Amidine - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available