Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)OC(=O)CN1C(=O)SC(=CC2=CC(Br)=C(O)C(I)=C2)C1=O

InChIKey

InChIKey=ATKMXOAWXWNGFG-UHFFFAOYSA-N

Formula

C16H15BrINO5S

Mass

540.17

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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 - 2-iodophenol - 2-bromophenol - 2-halophenol - Thiazolidinedione - Phenol - Iodobenzene - Halobenzene - Bromobenzene - Benzenoid - N-acyl-amine - Monocyclic benzene moiety - Thiazolidine - Dicarboximide - Thiocarbamic acid derivative - Carbonic acid derivative - Carboxylic acid ester - Azacycle - Iodoalkene - Bromoalkene - Haloalkene - Organoheterocyclic compound - Sulfenyl compound - Vinyl iodide - Vinyl halide - Vinyl bromide - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organoiodide - Organobromide - Organohalogen 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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