Structure Information
Structure

Compound Identification

SMILES

COCC1=C(C#N)C(OCC(=O)NN=CC2=CC=C(Br)C=C2)=NC(C)=C1Br

InChIKey

InChIKey=QPUNQGAYHFVKBA-UHFFFAOYSA-N

Formula

C18H16Br2N4O3

Mass

496.159

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyridines and derivatives

Subclass

3-pyridinecarbonitriles

Intermediate Tree Nodes

Not available

Direct Parent

3-pyridinecarbonitriles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

3-pyridinecarbonitrile - Alkyl aryl ether - Methylpyridine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Nitrile - Carbonitrile - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 3-pyridinecarbonitriles. These are organic compounds containing a pyridine ring substituted at the 3-position by a carbonitrile group.

External Descriptors

Not available

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