Structure Information
Structure

Compound Identification

SMILES

C[C@H]1CCC[C@H](C)C1COC(=O)N1CCN(CC2=CN=CN2CC2=CC=C(C=C2)C#N)CC1

InChIKey

InChIKey=JFRQHGVOCNTVHK-SFTDATJTSA-N

Formula

C26H35N5O2

Mass

449.599

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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

Imidazolyl carboxylic acids and derivatives Benzonitriles N-alkylpiperazines Aralkylamines N-substituted imidazoles Heteroaromatic compounds Carbamate esters Trialkylamines Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Piperazine-1-carboxylic acid - Benzonitrile - Imidazolyl carboxylic acid derivative - N-alkylpiperazine - Aralkylamine - Benzenoid - Monocyclic benzene moiety - N-substituted imidazole - Heteroaromatic compound - Azole - Carbamic acid ester - Imidazole - Tertiary aliphatic amine - Tertiary amine - Azacycle - Carbonitrile - Nitrile - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Cyanide - Carbonyl group - Organic nitrogen compound - Amine - Hydrocarbon derivative - 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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