Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(C(C[N+]([O-])=O)C1=CC2=C(OCO2)C=C1)C(=O)CCC1SCCS1

InChIKey

InChIKey=URRPJMNETXYERH-UHFFFAOYSA-N

Formula

C19H23NO7S2

Mass

441.51

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzodioxoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzodioxoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzodioxole - Beta-keto acid - Fatty acid ester - Fatty acyl - Keto acid - 1,3-dicarbonyl compound - Benzenoid - Thioacetal - Dithiolane - 1,3-dithiolane - Carboxylic acid ester - Organic nitro compound - Ketone - C-nitro compound - Acetal - Carboxylic acid derivative - Oxacycle - Dialkylthioether - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Organic oxoazanium - Thioether - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic salt - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Aldehyde - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.

External Descriptors

Not available

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