Structure Information
Structure

Compound Identification

SMILES

OC(=O)[C@H]1CN(C(=O)C1)C1=NNC2=C1C=CC(Br)=C2

InChIKey

InChIKey=AITKSAIKAXTKSG-ZCFIWIBFSA-N

Formula

C12H10BrN3O3

Mass

324.134

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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

Pyrrolidine carboxylic acids Oxoprolines Pyrrolidine-2-ones Aryl bromides Benzenoids Imidolactams Tertiary carboxylic acid amides Pyrazoles Heteroaromatic compounds Lactams Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organonitrogen compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives Organobromides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzopyrazole - Indazole - Oxoproline - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Aryl bromide - Aryl halide - Pyrrolidone - 2-pyrrolidone - Benzenoid - Imidolactam - Pyrrolidine - Heteroaromatic compound - Pyrazole - Tertiary carboxylic acid amide - Azole - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - 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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