Structure Information
Structure

Compound Identification

SMILES

CN1C2=C(N(CC(=O)OCCOC3=C(Cl)C=C(Cl)C=C3)C=N2)C(=O)N(C)C1=O

InChIKey

InChIKey=IKKPJALAEVGSNP-UHFFFAOYSA-N

Formula

C17H16Cl2N4O5

Mass

427.24

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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 - Xanthine - 6-oxopurine - Purinone - Alkaloid or derivatives - Imidazopyrimidine - Purine - Phenoxy compound - 1,3-dichlorobenzene - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Pyrimidone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Pyrimidine - Vinylogous amide - Azole - Imidazole - Heteroaromatic compound - Urea - Lactam - Carboxylic acid ester - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Ether - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organohalogen compound - Organic nitrogen compound - Organochloride - 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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