Structure Information
Structure

Compound Identification

SMILES

CSC[C@H](NC(=O)C(N)C(=O)OC[C@@H](NC(=O)C(Cl)Cl)[C@H](O)C1=CC=C(C=C1)S(C)(=O)=O)C=O

InChIKey

InChIKey=XJPDHYDVUWVXIF-KREAIGTHSA-N

Formula

C19H25Cl2N3O8S2

Mass

558.44

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Taxonomic Classification

Taxonomy Tree

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 - Alpha amino acids and derivatives

Direct Parent

Alpha amino acid esters

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Alpha-amino acid ester - Alpha-amino acid amide - Benzenesulfonyl group - Monocyclic benzene moiety - Benzenoid - 1,3-dicarbonyl compound - Sulfonyl - Sulfone - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Secondary alcohol - Dialkylthioether - Sulfenyl compound - Thioether - Monocarboxylic acid or derivatives - Alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Primary amine - Primary aliphatic amine - Aromatic alcohol - Hydrocarbon derivative - Carbonyl group - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl chloride - Aldehyde - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.

External Descriptors

Not available

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