Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@@H]1[C@@H](C#N)[C@H](C#N)[C@@H]2N1CCC1=CC(OC)=C(OC)C=C21

InChIKey

InChIKey=IGUYCVQUGVKKSF-CLROSIBMSA-N

Formula

C18H19N3O4

Mass

341.367

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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 - Tetrahydroisoquinoline - Anisole - Phenol ether - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Alkyl aryl ether - Aralkylamine - N-alkylpyrrolidine - Benzenoid - Methyl ester - Pyrrolidine - Tertiary aliphatic amine - Carboxylic acid ester - Tertiary amine - Organoheterocyclic compound - Ether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Azacycle - Cyanide - Amine - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - 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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