Structure Information
Structure

Compound Identification

SMILES

CC(=O)N[C@H](CC(O)=O)SC(=O)C1=CC=CC=C1OC(C)=O

InChIKey

InChIKey=NKETZBQITRSNRF-LBPRGKRZSA-N

Formula

C14H15NO6S

Mass

325.34

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Hydroxybenzoic acid derivatives - Salicylic acid and derivatives

Direct Parent

Acylsalicylic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Acylsalicylic acid or derivatives - Beta amino acid or derivatives - Phenol ester - Thiobenzoic acid or derivatives - Benzoyl - Phenoxy compound - Dicarboxylic acid or derivatives - N,s-acetal - Acetamide - Carboxamide group - Carboxylic acid ester - Carbothioic s-ester - Secondary carboxylic acid amide - Thiocarboxylic acid ester - Carboxylic acid derivative - Carboxylic acid - Sulfenyl compound - Hemithioaminal - Thiocarboxylic acid or derivatives - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Carbonyl group - Organopnictogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as acylsalicylic acids and derivatives. These are salicylic acids or derivatives, that are O-acylated.

External Descriptors

Not available

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