Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)OC(=O)N1N=C(C#C)C2=C1C=CC(Br)=C2

InChIKey

InChIKey=XUAIJXWMKKAZLZ-UHFFFAOYSA-N

Formula

C14H13BrN2O2

Mass

321.174

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzopyrazoles

Subclass

Indazoles

Intermediate Tree Nodes

Not available

Direct Parent

Indazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzopyrazole - Indazole - Pyrazole-1-carboxylic acid or derivatives - Aryl bromide - Benzenoid - Aryl halide - Heteroaromatic compound - Pyrazole - Azole - Acetylide - Azacycle - Organic oxide - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as indazoles. These are compounds containing an indazole, which is structurally characterized by a pyrazole fused to a benzene.

External Descriptors

Not available

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