Structure Information
Structure

Compound Identification

SMILES

CC(=O)N1CN(CC(Br)(C1)[N+]([O-])=O)C(C)=O

InChIKey

InChIKey=PQHBMGSHQZDVSY-UHFFFAOYSA-N

Formula

C8H12BrN3O4

Mass

294.105

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazines

Subclass

Pyrimidines and pyrimidine derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Nitropyrimidines

Alternative Parents

Molecular Framework

Aliphatic heteromonocyclic compounds

Substituents

Nitropyrimidine - 1,3-diazinane - Acetamide - Tertiary carboxylic acid amide - Carboxamide group - C-nitro compound - Organic nitro compound - Carboxylic acid derivative - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Alkyl bromide - Alkyl halide - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic cation - Aliphatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitropyrimidines. These are compounds containing a pyrimidine ring which bears a nitro group. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.

External Descriptors

Not available

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