Structure Information
Structure

Compound Identification

SMILES

BrC1=CC=CC=C1C1=C2CCCCN=C2N(N1)C1=CC2=C(OCCO2)C=C1

InChIKey

InChIKey=ZTLYHDFCARELDS-UHFFFAOYSA-N

Formula

C21H20BrN3O2

Mass

426.314

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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 - Alkyl aryl ether - Azepine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Para-dioxin - Benzenoid - Imidolactam - Pyrazoline - Carboxylic acid amidrazone - Azacycle - Amidine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Oxacycle - Ether - Organooxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Organobromide - Organonitrogen compound - 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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