Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=CC=C1CS(=O)(=O)N1CCC(CC1)C1=NC(=C(N1)C1=CC=CC=N1)C1=CC2=C(OCO2)C=C1

InChIKey

InChIKey=BSACKBHLZQSGCB-UHFFFAOYSA-N

Formula

C27H25N5O6S

Mass

547.59

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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

Nitrobenzene - Benzodioxole - 2,4,5-trisubstituted-imidazole - Nitroaromatic compound - Trisubstituted imidazole - Benzenoid - Organosulfonic acid amide - Organic sulfonic acid amide - Pyridine - Piperidine - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid or derivatives - Azole - Heteroaromatic compound - Imidazole - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Oxacycle - Organic oxoazanium - Azacycle - Acetal - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic zwitterion - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organopnictogen compound - Organic salt - Organic oxide - Hydrocarbon derivative - 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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