Compound Identification
SMILES
[I-].C[N+]1(CCOC(=O)C(C2CCCCC2)C2=CSC=C2)CCCCCC1
InChIKey
InChIKey=CXIYDSHFNSCHHW-UHFFFAOYSA-M
Formula
C21H34INO2S
Mass
491.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Azepanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azepanes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Azepanes
Alternative Parents
Thiophenes Tetraalkylammonium salts Heteroaromatic compounds Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Organic iodide salts Hydrocarbon derivatives Carbonyl compounds Amines Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Azepane - Quaternary ammonium salt - Thiophene - Heteroaromatic compound - Tetraalkylammonium salt - Carboxylic acid ester - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic nitrogen compound - Organic iodide salt - Organic salt - Amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as azepanes. These are organic compounds containing a saturated seven member heterocycle, with one nitrogen atom.
External Descriptors
Not available