Structure Information
Structure

Compound Identification

SMILES

CN1N=NN=C1C1=CC(NC(=O)N[C@@H]2CCNC[C@H]2CN2CCC[C@@H](CC3=CC=C(F)C=C3)C2)=CC(Br)=C1

InChIKey

InChIKey=IHWIZKJKIWNFNA-QYXIYQDXSA-N

Formula

C27H34BrFN8O

Mass

585.526

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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

3-benzylpiperidines

Alternative Parents

Phenyltetrazoles and derivatives N-phenylureas Aralkylamines Bromobenzenes Fluorobenzenes Aryl bromides Aryl fluorides Heteroaromatic compounds Ureas Trialkylamines Dialkylamines Azacyclic compounds Organic oxides Carbonyl compounds Organobromides Organofluorides Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

3-benzylpiperidine - Phenyltetrazole - N-phenylurea - Aralkylamine - Halobenzene - Fluorobenzene - Bromobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Azole - Heteroaromatic compound - Tetrazole - Urea - Tertiary aliphatic amine - Tertiary amine - Secondary aliphatic amine - Azacycle - Secondary amine - Amine - Organohalogen compound - Organobromide - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 3-benzylpiperidines. These are organic compounds containing a benzyl group attached to the 3-position of a piperidine.

External Descriptors

Not available

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