Compound Identification
SMILES
CC(=O)CC(O)C1=CC=[NH+]C=C1
InChIKey
InChIKey=TVUXQVOEAFYAJC-UHFFFAOYSA-O
Formula
C9H12NO2
Mass
166.199
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
Beta-hydroxy ketones Heteroaromatic compounds Secondary alcohols Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Aromatic alcohols Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Beta-hydroxy ketone - Pyridinium - Heteroaromatic compound - Ketone - Secondary alcohol - Azacycle - Aromatic alcohol - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Alcohol - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - 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