Structure Information
Structure

Compound Identification

SMILES

OCC1OC2(ON=C(S2)C2=CC=C(C=C2)[N+]([O-])=O)C(O)C(O)C1O

InChIKey

InChIKey=YVJHWAMIENOTBZ-UHFFFAOYSA-N

Formula

C13H14N2O8S

Mass

358.32

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Nitrobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Nitrobenzenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Nitrobenzene - Nitroaromatic compound - Monosaccharide - Oxane - Monothioacetal - 1,2-diol - C-nitro compound - Organic nitro compound - Secondary alcohol - Oxacycle - Organic oxoazanium - Azacycle - Polyol - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Primary alcohol - Organic oxide - Organic zwitterion - Hydrocarbon derivative - Organic nitrogen compound - Alcohol - Organic salt - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.

External Descriptors

Not available

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