Compound Identification
SMILES
CC1=C(C(=O)OC2=C[NH+]=CC=C2)C(=NO1)C1=CC=CC=C1
InChIKey
InChIKey=JTUKUPPGKXAFGS-UHFFFAOYSA-O
Formula
C16H13N2O3
Mass
281.29
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
- Subclass Pyridinium derivatives
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Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyridinium derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyridinium derivatives
Alternative Parents
Benzene and substituted derivatives Isoxazoles Heteroaromatic compounds Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Monocyclic benzene moiety - Benzenoid - Pyridinium - Azole - Isoxazole - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinium derivatives. These are compounds containing a pyridinium ring, which is the cationic form of pyridine.
External Descriptors
Not available