Compound Identification
SMILES
[O-][N+](=O)C1=CC(COC(=O)CCSC2=CC=C(Cl)C=C2)=C2OCOCC2=C1
InChIKey
InChIKey=ZDCOJSODSCCIOM-UHFFFAOYSA-N
Formula
C18H16ClNO6S
Mass
409.84
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-1,3-dioxanes
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Class
Benzodioxanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxanes
Subclass
Benzo-1,3-dioxanes
Intermediate Tree Nodes
Not available
Direct Parent
Benzo-1,3-dioxanes
Alternative Parents
Thiophenol ethers Nitroaromatic compounds Alkylarylthioethers Chlorobenzenes Aryl chlorides Carboxylic acid esters Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Acetals Organic oxoazanium compounds Monocarboxylic acids and derivatives Organopnictogen compounds Hydrocarbon derivatives Organic oxides Organic salts Carbonyl compounds Organochlorides Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-1,3-dioxane - Aryl thioether - Nitroaromatic compound - Thiophenol ether - Chlorobenzene - Halobenzene - Alkylarylthioether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Carboxylic acid ester - Organic nitro compound - C-nitro compound - Acetal - Carboxylic acid derivative - Oxacycle - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Organic oxoazanium - Thioether - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Organic salt - Organic oxide - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzo-1,3-dioxanes. These are heterocyclic compounds containing a benzene ring fused to a 1,3-dioxane ring.
External Descriptors
Not available