Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC=C(NC2=NC(=O)C3N=CN=C3N2)C=C1

InChIKey

InChIKey=BMXHWKAGEYEDMK-UHFFFAOYSA-N

Formula

C13H11N5O3

Mass

285.263

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Benzoic acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid or derivatives - Benzoate ester - Benzoyl - Aniline or substituted anilines - Pyrimidone - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Pyrimidine - Imidolactam - Imidazole - Methyl ester - Carboxylic acid ester - Guanidine - N-acylimine - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Carboxylic acid amidine - Carboxylic acid derivative - Amidine - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic 1,3-dipolar compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.

External Descriptors

Not available

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