Structure Information
Structure

Compound Identification

SMILES

CC1=C(C=C(C=C1[N+]([O-])=O)C(=O)OC1=CC=CC(=C1)C(=S)N1CCOCC1)[N+]([O-])=O

InChIKey

InChIKey=CGOPXBZJVUGHRM-UHFFFAOYSA-N

Formula

C19H17N3O7S

Mass

431.42

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Depsides and depsidones

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Depsides and depsidones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Depside backbone - Dinitrotoluene - Nitrobenzoate - Benzoate ester - Phenol ester - Benzoic acid or derivatives - Nitrobenzene - Nitrotoluene - Phenoxy compound - Nitroaromatic compound - Benzoyl - Toluene - Monocyclic benzene moiety - Morpholine - Oxazinane - Benzenoid - Thioamide - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Organoheterocyclic compound - Thiocarboxylic acid amide - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Dialkyl ether - Ether - Organic 1,3-dipolar compound - Oxacycle - Azacycle - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Thiocarbonyl group - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as depsides and depsidones. These are polycyclic compounds that is either a polyphenolic compound composed of two or more monocyclic aromatic units linked by an ester bond (depside), or a compound containing the depsidone structure (depsidone).

External Descriptors

Not available

Previous Back Next