Compound Identification
SMILES
COC(=O)C=C1SC(=CC(=O)OC)C2=CC=CC=C12
InChIKey
InChIKey=IISWLGQQRQEIAL-UHFFFAOYSA-N
Formula
C14H12O4S
Mass
276.31
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzothiophenes
- Subclass 2-benzothiophenes
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Class
Benzothiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiophenes
Subclass
2-benzothiophenes
Intermediate Tree Nodes
Not available
Direct Parent
2-benzothiophenes
Alternative Parents
Dicarboxylic acids and derivatives Benzenoids Thiophenes Methyl esters Heteroaromatic compounds Enoate esters Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-benzothiophene - Dicarboxylic acid or derivatives - Benzenoid - Thiophene - Methyl ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Carbonyl group - Organooxygen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-benzothiophenes. These are aromatic heterocyclic compound containing the 2-benzothiophene ring system, in which the benzene ring is fused to the thiophene ring across positions 3 and 4.
External Descriptors
Not available