Structure Information
Structure

Compound Identification

SMILES

[Br-].CC(C)(C)OC(=O)N1CCN(CC2=C[N+](CC#N)=CC=C2)CC1

InChIKey

InChIKey=ILHSTUMRFVFORO-UHFFFAOYSA-M

Formula

C17H25BrN4O2

Mass

397.317

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazinanes

Subclass

Piperazines

Intermediate Tree Nodes

Piperazine carboxylic acids and derivatives

Direct Parent

Piperazine carboxylic acids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Piperazine-1-carboxylic acid - N-alkylpiperazine - Aralkylamine - Pyridine - Pyridinium - Heteroaromatic compound - Carbamic acid ester - Tertiary amine - Tertiary aliphatic amine - Carbonitrile - Nitrile - Azacycle - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Amine - Organic bromide salt - Organic salt - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as piperazine carboxylic acids. These are heterocyclic compounds containing a piperazine ring substituted by one or more carboxylic acid groups.

External Descriptors

Not available

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