Compound Identification
SMILES
[I-].COC(=O)C1=C(OCC2=CC=CC=C2)C=CC(=C1)[C@@H](O)C[N+](C)(C)C
InChIKey
InChIKey=UAQHTZYYBDIYHO-FERBBOLQSA-M
Formula
C20H26INO4
Mass
471.335
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
-
Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
Phenoxy compounds Phenol ethers Benzoyl derivatives Cholines Aralkylamines Alkyl aryl ethers Tetraalkylammonium salts Methyl esters Secondary alcohols 1,2-aminoalcohols Organic zwitterions Organic oxides Organic iodide salts Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzoate ester - Phenoxy compound - Benzoyl - Phenol ether - Alkyl aryl ether - Aralkylamine - Choline - Tetraalkylammonium salt - Methyl ester - Quaternary ammonium salt - 1,2-aminoalcohol - Carboxylic acid ester - Secondary alcohol - Carboxylic acid derivative - Ether - Organooxygen compound - Organonitrogen compound - Alcohol - Organic salt - Organic iodide salt - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organic zwitterion - Aromatic alcohol - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available