Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)[C@H](C(C)C)N1CN=C(N[N+]([O-])=O)N(CC2=CN=C(Cl)C=C2)C1

InChIKey

InChIKey=GBIFITSTNNQZOI-AWEZNQCLSA-N

Formula

C16H23ClN6O4

Mass

398.85

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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 - Valine or derivatives - Nitroguanidine - Fatty acid ester - 2-halopyridine - Triazine - Pyridine - Fatty acyl - 1,3,5-triazine - Aryl chloride - Aryl halide - Nitramine - Heteroaromatic compound - Organic nitro compound - Guanidine - Carboxylic acid ester - Tertiary amine - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboximidamide - Organochloride - Organohalogen compound - Organic salt - Imine - Amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic zwitterion - 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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