Compound Identification
SMILES
ClC1=CC(Cl)=C(CN2C=C(\C=N\NC(=O)CNC3=CC4=C(OCO4)C=C3)C3=CC=CC=C23)C=C1
InChIKey
InChIKey=QKQBLVBNYJFRBT-VPUKRXIYSA-N
Formula
C25H20Cl2N4O3
Mass
495.36
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
N-alkylindoles Indoles Benzodioxoles Dichlorobenzenes Secondary alkylarylamines Substituted pyrroles Aryl chlorides Heteroaromatic compounds Oxacyclic compounds Acetals Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - N-alkylindole - Indole or derivatives - Indole - Benzodioxole - 1,3-dichlorobenzene - Secondary aliphatic/aromatic amine - Halobenzene - Chlorobenzene - Benzenoid - Substituted pyrrole - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Pyrrole - Heteroaromatic compound - Acetal - Oxacycle - Azacycle - Organoheterocyclic compound - Secondary amine - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organochloride - Aromatic heteropolycyclic 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