Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1CCC(=O)N1S(=O)(=O)C1=CC=C(C)C=C1

InChIKey

InChIKey=XFQDWAIQPTTZAF-UHFFFAOYSA-N

Formula

C13H15NO5S

Mass

297.33

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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 heteromonocyclic compounds

Substituents

Alpha-amino acid ester - Proline or derivatives - Benzenesulfonamide - Tosyl compound - Benzenesulfonyl group - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Oxoproline - Toluene - Monocyclic benzene moiety - Benzenoid - Pyrrolidone - 2-pyrrolidone - Pyrrolidine - Methyl ester - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Lactam - Carboxylic acid ester - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Aromatic heteromonocyclic 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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