Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

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

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

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