Structure Information
Structure

Compound Identification

SMILES

CN(CC(=O)OC(C)(C)C)C1=C(C(OC2=CC=CC3=C2OC(=C3)C(C)=O)=NC=N1)[N+]([O-])=O

InChIKey

InChIKey=QSXUZPKGLLWFTM-UHFFFAOYSA-N

Formula

C21H22N4O7

Mass

442.428

Export to:

JSON SDF CSV

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 - Diaryl ether - Benzofuran - Nitroaromatic compound - Phenol ether - Aryl ketone - Aryl alkyl ketone - Dialkylarylamine - Aminopyrimidine - Pyrimidine - Benzenoid - Imidolactam - Furan - Heteroaromatic compound - Organic nitro compound - Carboxylic acid ester - Ketone - C-nitro compound - Organoheterocyclic compound - Azacycle - Ether - Oxacycle - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Organic oxide - Carbonyl group - Organic salt - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Organic zwitterion - Amine - 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

Previous Back Next