Compound Identification
SMILES
OC(=O)C(O)=O.COCOC1CN(CCCOCCC2=CC3=C(SC=C3)C=C2)C1
InChIKey
InChIKey=JQXCNPKIOQXKCF-UHFFFAOYSA-N
Formula
C20H27NO7S
Mass
425.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzothiophenes
- Subclass 1-benzothiophenes
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Class
Benzothiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiophenes
Subclass
1-benzothiophenes
Intermediate Tree Nodes
Not available
Direct Parent
1-benzothiophenes
Alternative Parents
Dicarboxylic acids and derivatives Benzenoids Thiophenes Heteroaromatic compounds Trialkylamines Azetidines Dialkyl ethers Carboxylic acids Azacyclic compounds Acetals Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
1-benzothiophene - Dicarboxylic acid or derivatives - Benzenoid - Thiophene - Heteroaromatic compound - Azetidine - Tertiary amine - Tertiary aliphatic amine - Acetal - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Azacycle - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzothiophenes. These are aromatic heterocyclic compound containing the Benzo[b]thiophene ring system.
External Descriptors
Not available