Structure Information
Structure

Compound Identification

SMILES

CC(=O)NC1=CC=C(OC(=O)C2=NC(CO[N+]([O-])=O)=CC=C2)C=C1

InChIKey

InChIKey=VVETWMCPPIVLEY-UHFFFAOYSA-N

Formula

C15H13N3O6

Mass

331.284

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenol esters

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Phenol esters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Acetanilide - Phenol ester - N-acetylarylamine - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Anilide - Phenoxy compound - N-arylamide - Monocyclic benzene moiety - Pyridine - Organic nitrate - Heteroaromatic compound - Alkyl nitrate - Acetamide - Carboxamide group - Carboxylic acid ester - Organic nitric acid or derivatives - Organic nitro compound - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organic salt - Organic zwitterion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenol esters. These are aromatic compounds containing a benzene ring substituted by a hydroxyl group and an ester group.

External Descriptors

Not available

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