Structure Information
Structure

Compound Identification

SMILES

CC(=O)N\C(=C/C1=CC=CC=C1)C(=O)OCC(=O)C1=CC=C(C)S1

InChIKey

InChIKey=XFZXREMBVRHGPA-GDNBJRDFSA-N

Formula

C18H17NO4S

Mass

343.4

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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

N-acyl-alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-acyl-alpha amino acid or derivatives - Cinnamic acid or derivatives - Cinnamic acid ester - Aryl alkyl ketone - Aryl ketone - Fatty acid ester - Alpha-acyloxy ketone - 2,5-disubstituted thiophene - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Heteroaromatic compound - Acetamide - Thiophene - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxamide group - Carboxylic acid ester - Ketone - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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