Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(\C=N/NC(=O)C2CC[NH+](CC3=CC=C(Br)C=C3)CC2)C=C1

InChIKey

InChIKey=IFRBNMIXXRUTQL-UCQKPKSFSA-O

Formula

C21H25BrN3O

Mass

415.354

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Piperidines

Subclass

Benzylpiperidines

Intermediate Tree Nodes

Not available

Direct Parent

N-benzylpiperidines

Alternative Parents

Piperidinecarboxamides Benzylamines Phenylmethylamines Aralkylamines Bromobenzenes Toluenes Aryl bromides Quaternary ammonium salts Trialkylamines Amino acids and derivatives Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-benzylpiperidine - Piperidinecarboxamide - Benzylamine - Phenylmethylamine - Halobenzene - Aralkylamine - Bromobenzene - Toluene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Quaternary ammonium salt - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Azacycle - Carboxylic acid derivative - Amine - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-benzylpiperidines. These are heterocyclic Compounds containing a piperidine ring conjugated to a benzyl group through one nitrogen ring atom.

External Descriptors

Not available

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