Compound Identification
SMILES
CC1=C(C=CC(OC(=O)C2=CC=[N+](C)C=C2)=C1)[N+]([O-])=O
InChIKey
InChIKey=GJUSCOWHSCTHQH-UHFFFAOYSA-N
Formula
C14H13N2O4
Mass
273.267
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
Pyridinecarboxylic acids Nitrotoluenes Nitrobenzenes Phenoxy compounds Nitroaromatic compounds N-methylpyridinium compounds Pyridinium derivatives Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Organic oxoazanium compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives Organic salts Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenol ester - Nitrobenzene - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Nitrotoluene - Phenoxy compound - Nitroaromatic compound - N-methylpyridinium - Toluene - Monocyclic benzene moiety - Pyridine - Pyridinium - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Organic oxoazanium - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organic salt - Organic cation - 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