Compound Identification
SMILES
CS([O-])(=O)=O.COC1=CC=CC=C1OC(=O)CCC1=CC=C(C=C1)C(N)=N
InChIKey
InChIKey=MRGYDESUNIFXJH-UHFFFAOYSA-M
Formula
C18H21N2O6S
Mass
393.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Phenol esters
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol esters
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenol esters
Alternative Parents
Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Fatty acid esters Sulfonyls Organosulfonic acids Alkanesulfonic acids Carboxylic acid esters Monocarboxylic acids and derivatives Carboximidamides Carboxamidines Organic oxides Carbonyl compounds Hydrocarbon derivatives Organic anions
Molecular Framework
Not available
Substituents
Phenol ester - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Alkanesulfonic acid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Carboxylic acid ester - Carboximidamide - Amidine - Carboxylic acid amidine - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic anion - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenol esters. These are aromatic compounds containing a benzene ring substituted by a hydroxyl group and an ester group.
External Descriptors
Not available