Structure Information
Structure

Compound Identification

SMILES

CN1N=CC(C=NNC(=O)C2=C(O)C=C(Br)C=C2)=C1C

InChIKey

InChIKey=CMHDXUQUSLKVGN-UHFFFAOYSA-N

Formula

C13H13BrN4O2

Mass

337.177

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Hydroxybenzoic acid derivatives - Salicylic acid and derivatives

Direct Parent

Salicylamides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Salicylamide - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoyl - 3-halophenol - 3-bromophenol - Bromobenzene - Halobenzene - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aryl bromide - Aryl halide - Heteroaromatic compound - Pyrazole - Vinylogous acid - Azole - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxide - Organohalogen compound - Organobromide - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as salicylamides. These are carboxamide derivatives of salicylic acid. Salicylic acid is the ortho-hydroxylated derivative of benzoic acid.

External Descriptors

Not available

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