Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC2=C(OCCO2)C=C1NC(=O)C(=CC1=C(N=C(S1)N1CCOCC1)C1=CC=CC=C1)C#N

InChIKey

InChIKey=LENQPIHJQZPLTD-UHFFFAOYSA-N

Formula

C25H21N5O6S

Mass

519.53

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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 - 2,4,5-trisubstituted 1,3-thiazole - Nitroaromatic compound - Dialkylarylamine - N-arylamide - Alkyl aryl ether - Monocyclic benzene moiety - Morpholine - Oxazinane - Para-dioxin - 1,3-thiazol-2-amine - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Carboxamide group - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Carbonitrile - Nitrile - Organic oxoazanium - Azacycle - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Cyanide - Amine - Organic salt - 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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