Structure Information
Structure

Compound Identification

SMILES

CC(C)OC(=O)CN1C(=O)N(C)C(=O)N(C1=O)C1=C(Cl)C=C(F)C(=C1)N=C1OC(=O)N2CCCCN12

InChIKey

InChIKey=CWNGQDYSSUZMQV-UHFFFAOYSA-N

Formula

C21H22ClFN6O7

Mass

524.89

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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 heteropolycyclic compounds

Substituents

Alpha-amino acid ester - Fluorobenzene - Halobenzene - Chlorobenzene - Triazinone - Aryl chloride - Aryl fluoride - Monocyclic benzene moiety - Aryl halide - Pyridazine - Triazine - Benzenoid - 1,3,5-triazine - Oxadiazole - Heteroaromatic compound - Azole - 1,3,4-oxadiazole - Carboxylic acid ester - Urea - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Oxacycle - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic 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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