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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Phenol esters
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol esters
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenol esters
Alternative Parents
Acetanilides Pyridinecarboxylic acids N-acetylarylamines Phenoxy compounds Acetamides Alkyl nitrates Heteroaromatic compounds Secondary carboxylic acid amides Organic nitro compounds Organic nitric acids and derivatives Carboxylic acid esters Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
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