Compound Identification
SMILES
[Na+].CC1=C\C(=C(\NCCCC([O-])=O)C2=CC=CC=C2Cl)C(=O)C=C1
InChIKey
InChIKey=JJLKWYQTMUHPLD-NYAKATHWSA-M
Formula
C18H17ClNNaO3
Mass
353.78
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
Gamma amino acids and derivatives
Alternative Parents
O-quinomethanes Amino fatty acids Chlorobenzenes Aryl chlorides Vinylogous amides Carboxylic acid salts Carboxylic acids Organic metal halides Dialkylamines Enamines Monocarboxylic acids and derivatives Organic oxides Organochlorides Hydrocarbon derivatives Organic sodium salts Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Gamma amino acid or derivatives - O-quinomethane - Quinomethane - Amino fatty acid - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Vinylogous amide - Ketone - Carboxylic acid salt - Cyclic ketone - Enamine - Secondary aliphatic amine - Carboxylic acid - Organic alkali metal salt - Monocarboxylic acid or derivatives - Organic metal halide - Amine - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic salt - Organic sodium salt - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as gamma amino acids and derivatives. These are amino acids having a (-NH2) group attached to the gamma carbon atom.
External Descriptors
Not available