Compound Identification
SMILES
[I-].CSC(=CC1=CC=CC=[N+]1C)N1CCOCC1
InChIKey
InChIKey=ZJCMAULNLLCUMK-UHFFFAOYSA-M
Formula
C13H19IN2OS
Mass
378.27
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
-
Subclass
Methylpyridines
- Level 5 N-methylpyridinium compounds
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Subclass
Methylpyridines
-
Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Methylpyridines
Intermediate Tree Nodes
Not available
Direct Parent
N-methylpyridinium compounds
Alternative Parents
Pyridinium derivatives Morpholines Heteroaromatic compounds Ketene acetals Sulfenyl compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organonitrogen compounds Organic iodide salts Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-methylpyridinium - Morpholine - Oxazinane - Pyridinium - Heteroaromatic compound - Ketene acetal or derivatives - Dialkyl ether - Ether - Oxacycle - Sulfenyl compound - Azacycle - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic salt - Organic iodide salt - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-methylpyridinium compounds. These are methylpyridines that carry a methyl group at the 1-position.
External Descriptors
Not available