Structure Information
Structure

Compound Identification

SMILES

OCCNC1=C(C=C(CO)C=C1)[N+]([O-])=O

InChIKey

InChIKey=HOHROYDXEIEQRW-UHFFFAOYSA-N

Formula

C9H12N2O4

Mass

212.205

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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 homomonocyclic compounds

Substituents

Nitrobenzene - Benzyl alcohol - Aniline or substituted anilines - Phenylalkylamine - Nitroaromatic compound - Secondary aliphatic/aromatic amine - Organic nitro compound - 1,2-aminoalcohol - C-nitro compound - Alkanolamine - Organic oxoazanium - Secondary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic salt - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Alcohol - Organic oxide - Aromatic alcohol - Organic zwitterion - Hydrocarbon derivative - Amine - Aromatic homomonocyclic 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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