Compound Identification
SMILES
CN(CC(=O)NC1=CC=C(Cl)C=C1)C(=O)COC1=CC(Br)=CC=C1
InChIKey
InChIKey=KNPLVHSVXYDMEB-UHFFFAOYSA-N
Formula
C17H16BrClN2O3
Mass
411.68
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
Anilides N-arylamides Phenol ethers Phenoxy compounds Alkyl aryl ethers Chlorobenzenes Bromobenzenes Aryl chlorides Aryl bromides Tertiary carboxylic acid amides Secondary carboxylic acid amides Organochlorides Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Anilide - Phenoxy compound - Phenol ether - N-arylamide - Alkyl aryl ether - Bromobenzene - Chlorobenzene - Halobenzene - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Aryl bromide - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Carboxamide group - Ether - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Organic nitrogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic 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