Structure Information
Structure

Compound Identification

SMILES

OC1=C(C=C(C=C1C=C1SC(NN=CC2=CC=CC=C2)=NC1=O)[N+]([O-])=O)[N+]([O-])=O

InChIKey

InChIKey=RJIMZKSEDFDDJU-UHFFFAOYSA-N

Formula

C17H11N5O6S

Mass

413.36

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenols

Subclass

Nitrophenols

Intermediate Tree Nodes

Not available

Direct Parent

Dinitrophenols

Alternative Parents

Nitrobenzenes Nitroaromatic compounds Thiazolines N-acylimines Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Carboxylic acids and derivatives Azacyclic compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Dinitrophenol - Nitrobenzene - Nitroaromatic compound - Monocyclic benzene moiety - Meta-thiazoline - C-nitro compound - N-acylimine - Organic nitro compound - Carboxylic acid derivative - Organic oxoazanium - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic zwitterion - Organic oxygen compound - Organic oxide - Organic salt - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as dinitrophenols. These are organic aromatic compounds containing a benzene that carries a single phenol group and exactly two nitro groups.

External Descriptors

Not available

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