Compound Identification
SMILES
CCOC(=O)[C@H](CC1=CC2=C(OCCO2)C=C1)C(S)=O
InChIKey
InChIKey=JNDKHHUWGATXFE-JTQLQIEISA-N
Formula
C14H16O5S
Mass
296.34
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzodioxanes
- Subclass Benzo-1,4-dioxanes
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Class
Benzodioxanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxanes
Subclass
Benzo-1,4-dioxanes
Intermediate Tree Nodes
Not available
Direct Parent
Benzo-1,4-dioxanes
Alternative Parents
Fatty acid esters Alkyl aryl ethers Para dioxins Benzenoids 1,3-dicarbonyl compounds Carboxylic acid esters Carbothioic S-acids Carbodithioic acids Thiocarboxylic acids and derivatives Oxacyclic compounds Monocarboxylic acids and derivatives Alkylthiols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-1,4-dioxane - Alkyl aryl ether - Fatty acid ester - Fatty acyl - Benzenoid - 1,3-dicarbonyl compound - Para-dioxin - Carbodithioic acid - Carbothioic s-acid - Carboxylic acid ester - Alkylthiol - Oxacycle - Carboxylic acid derivative - Thiocarboxylic acid or derivatives - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Carbonyl group - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzo-1,4-dioxanes. These are heterocyclic compounds containing a benzene ring fused to a 1,4-dioxane ring.
External Descriptors
Not available