Structure Information
Structure

Compound Identification

SMILES

OCC1=C(CNCCC2=CC=CC=C2)C=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=ZLUQDYJYBGNECH-UHFFFAOYSA-N

Formula

C16H18N2O3

Mass

286.331

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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 - Phenethylamine - Benzyl alcohol - Nitroaromatic compound - Benzylamine - Phenylmethylamine - Aralkylamine - C-nitro compound - Organic nitro compound - Secondary aliphatic amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Secondary amine - Alcohol - Primary alcohol - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic alcohol - Organic oxide - Organic zwitterion - Organic salt - Organic oxygen compound - Organic nitrogen compound - 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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