Structure Information
Structure

Compound Identification

SMILES

CCC1=CC(=CC2=C(O)C=CC(=C2)[N+]([O-])=O)C(=O)S1

InChIKey

InChIKey=BONUUNUJQVSEPN-UHFFFAOYSA-N

Formula

C13H11NO4S

Mass

277.29

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenols

Subclass

Nitrophenols

Intermediate Tree Nodes

Not available

Direct Parent

Nitrophenols

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Nitrophenol - Nitrobenzene - Nitroaromatic compound - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - 2,3-dihydrothiophene - Carbothioic s-lactone - C-nitro compound - Organic nitro compound - Thiocarboxylic acid ester - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxoazanium - Thiocarboxylic acid or derivatives - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organic salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitrophenols. These are compounds containing a nitrophenol moiety, which consists of a benzene ring bearing both a hydroxyl group and a nitro group on two different ring carbon atoms.

External Descriptors

Not available

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