Structure Information
Structure

Compound Identification

SMILES

CC1=NN(C(=O)C2=C(C)C(=CC=C2)[N+]([O-])=O)C(C)=C1

InChIKey

InChIKey=JWMAYJNCVPAWLO-UHFFFAOYSA-N

Formula

C13H13N3O3

Mass

259.265

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoyl derivatives

Intermediate Tree Nodes

Benzoylpyrazoles

Direct Parent

N-benzoylpyrazoles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-benzoylpyrazole - Benzoic acid or derivatives - Nitrobenzene - O-toluamide - Toluamide - Nitrotoluene - Nitroaromatic compound - Toluene - Azole - Pyrazole - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Organic oxoazanium - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-benzoylpyrazoles. These are aromatic heterocyclic compounds containing a pyrazole ring that is N-substituted at the 1-position by a benzoyl group.

External Descriptors

Not available

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