Structure Information
Structure

Compound Identification

SMILES

CN(CC(=O)OC(C)(C)C)C1=NC=NC(N2CCC(CC2)N2N=NC3=CC=CC=C23)=C1[N+]([O-])=O

InChIKey

InChIKey=KRPONTYMNBXWKQ-UHFFFAOYSA-N

Formula

C22H28N8O4

Mass

468.518

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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 - Benzotriazole - Nitroaromatic compound - Dialkylarylamine - Aminopyrimidine - Imidolactam - Piperidine - Pyrimidine - Benzenoid - Azole - Heteroaromatic compound - Triazole - 1,2,3-triazole - Carboxylic acid ester - Organic nitro compound - C-nitro compound - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxygen compound - Amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic salt - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic cation - 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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