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Structure Information
Structure

Compound Identification

SMILES

CCC1=CC(=NC=C1)N1N=NN=C1COC1=C(OC)C=C(CC#N)C=C1Br

InChIKey

InChIKey=LVWHEJKGNSYWIC-UHFFFAOYSA-N

Formula

C18H17BrN6O2

Mass

429.278

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzyl cyanides

Intermediate Tree Nodes

Not available

Direct Parent

Benzyl cyanides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzyl-cyanide - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Pyridine - Heteroaromatic compound - Azole - Tetrazole - Azacycle - Organoheterocyclic compound - Ether - Carbonitrile - Nitrile - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Cyanide - Hydrocarbon derivative - Organohalogen compound - Organobromide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzyl cyanides. These are organic compounds containing an acetonitrile with one hydrogen replaced by a phenyl group.

External Descriptors

Not available

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