Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)N1CCN(CC1)C1=C(C(NNC(=O)C2=CC=C(Br)C=C2)=NC=N1)[N+]([O-])=O

InChIKey

InChIKey=MPRMOSHELHMOAP-UHFFFAOYSA-N

Formula

C18H20BrN7O5

Mass

494.306

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazinanes

Subclass

Piperazines

Intermediate Tree Nodes

Not available

Direct Parent

N-arylpiperazines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-arylpiperazine - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Piperazine-1-carboxylic acid - Benzoic acid or derivatives - Nitroaromatic compound - Benzoyl - Dialkylarylamine - Bromobenzene - Halobenzene - Aminopyrimidine - Imidolactam - Pyrimidine - Benzenoid - Aryl halide - Aryl bromide - Monocyclic benzene moiety - Carbamic acid ester - Heteroaromatic compound - Carboxylic acid hydrazide - C-nitro compound - Organic nitro compound - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organic salt - Amine - Organic zwitterion - Organohalogen compound - Hydrocarbon derivative - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-arylpiperazines. These are organic compounds containing a piperazine ring where the nitrogen ring atom carries an aryl group.

External Descriptors

Not available

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