Structure Information
Structure

Compound Identification

SMILES

CC1=C(C=CC(=C1)C(=O)NC1=NC(=CS1)C1=CC2=C(OCCO2)C=C1)[N+]([O-])=O

InChIKey

InChIKey=QDHZBSIDOPJELE-UHFFFAOYSA-N

Formula

C19H15N3O5S

Mass

397.41

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzo-1,4-dioxane - Nitrobenzene - Nitrotoluene - Benzoic acid or derivatives - Toluamide - M-toluamide - Benzamide - Benzoyl - Nitroaromatic compound - 2,4-disubstituted 1,3-thiazole - Toluene - Alkyl aryl ether - Monocyclic benzene moiety - Para-dioxin - Benzenoid - Heteroaromatic compound - Thiazole - Azole - Organic nitro compound - Carboxamide group - C-nitro compound - Secondary carboxylic acid amide - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Ether - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic salt - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic zwitterion - 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

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