Structure Information
Structure

Compound Identification

SMILES

CN1CCCC1C(=O)C1=C(C)C=CC=C1[N+]([O-])=O

InChIKey

InChIKey=YWBCGXDEAILVNN-UHFFFAOYSA-N

Formula

C13H16N2O3

Mass

248.282

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Aryl ketones - Phenylketones

Direct Parent

Alkyl-phenylketones

Alternative Parents

Nitrotoluenes Nitrobenzenes Nitroaromatic compounds Benzoyl derivatives Aryl alkyl ketones N-alkylpyrrolidines Alpha-amino ketones Trialkylamines Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alkyl-phenylketone - Nitrobenzene - Nitrotoluene - Benzoyl - Nitroaromatic compound - Aryl alkyl ketone - Toluene - Monocyclic benzene moiety - N-alkylpyrrolidine - Benzenoid - Alpha-aminoketone - Pyrrolidine - Organic nitro compound - C-nitro compound - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organic 1,3-dipolar compound - Organic oxoazanium - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Amine - Hydrocarbon derivative - Organic salt - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organic zwitterion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.

External Descriptors

Not available

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