Compound Identification
SMILES
COC(=O)C1=CC2=C(CCC(COS(C)(=O)=O)=C2)S1
InChIKey
InChIKey=AAGZEFNWCLWXEW-UHFFFAOYSA-N
Formula
C12H14O5S2
Mass
302.36
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiophenes
Subclass
Thiophene carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Thiophene carboxylic acids and derivatives
Alternative Parents
2,3,5-trisubstituted thiophenes Sulfonic acid esters Organosulfonic acid esters Sulfonyls Methyl esters Methanesulfonates Heteroaromatic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thiophene carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - Sulfonic acid ester - Organosulfonic acid ester - Methyl ester - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Methanesulfonate - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thiophene carboxylic acids and derivatives. These are compounds containing a thiophene ring which bears a carboxylic acid group (or a salt/ester thereof).
External Descriptors
Not available