Compound Identification
SMILES
Cl.C(CNC1CCN(CC2=CC=CC=C2)CC1)CN1\C(SC2=CC=CC=C12)=C\C1=CC=[N+](CCCNC2CCN(CC3=CC=CC=C3)CC2)C2=CC=CC=C12
InChIKey
InChIKey=PLXDZRMPJGRMTN-UHFFFAOYSA-N
Formula
C47H58ClN6S
Mass
774.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Piperidines
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Subclass
Benzylpiperidines
- Level 5 N-benzylpiperidines
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Subclass
Benzylpiperidines
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Class
Piperidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Piperidines
Subclass
Benzylpiperidines
Intermediate Tree Nodes
Not available
Direct Parent
N-benzylpiperidines
Alternative Parents
Quinolines and derivatives Benzothiazoles Aryl thioethers Benzylamines Phenylmethylamines Aralkylamines Aminopiperidines Pyridinium derivatives Heteroaromatic compounds Thiazoles Ketene acetals Trialkylamines Dialkylamines Azacyclic compounds Hydrochlorides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-benzylpiperidine - Quinoline - Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Benzylamine - Phenylmethylamine - 4-aminopiperidine - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Pyridine - Pyridinium - Heteroaromatic compound - Thiazole - Ketene acetal or derivatives - Tertiary aliphatic amine - Tertiary amine - Secondary aliphatic amine - Azacycle - Secondary amine - Amine - Organonitrogen compound - Organic nitrogen compound - Hydrochloride - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic 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