Structure Information
Structure

Compound Identification

SMILES

CC1=CC(Br)=C(NC2=CC(NC3=CC=C(C=C3)C#N)=NC=C2[N+]([O-])=O)C(Br)=C1

InChIKey

InChIKey=YTPMKUIAIPFZSL-UHFFFAOYSA-N

Formula

C19H13Br2N5O2

Mass

503.154

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzonitriles

Intermediate Tree Nodes

Not available

Direct Parent

Benzonitriles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzonitrile - 2-bromoaniline - Aniline or substituted anilines - Aminotoluene - Nitroaromatic compound - Bromobenzene - Halobenzene - Toluene - Aminopyridine - Aryl halide - Aryl bromide - Imidolactam - Primary aromatic amine - Pyridine - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Azacycle - Carbonitrile - Nitrile - Organoheterocyclic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Secondary amine - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organohalogen compound - Cyanide - Organic oxygen compound - Organic oxide - Organobromide - Organonitrogen compound - Organic salt - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic zwitterion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.

External Descriptors

Not available

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