Compound Identification
SMILES
Cl.COC1=CC=CC(C(=O)NC2CC3CCC(C2)N3CC2=CC=C(C=C2)C#N)=C1OC
InChIKey
InChIKey=NXPXHCDJCLURJJ-UHFFFAOYSA-N
Formula
C24H28ClN3O3
Mass
441.96
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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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
Dimethoxybenzenes Tropane alkaloids Benzamides Anisoles Benzonitriles Benzoyl derivatives Benzylamines Phenoxy compounds Phenylmethylamines Aralkylamines Alkyl aryl ethers N-alkylpyrrolidines Secondary carboxylic acid amides Amino acids and derivatives Trialkylamines Nitriles Azacyclic compounds Hydrocarbon derivatives Hydrochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-benzylpiperidine - Dimethoxybenzene - O-dimethoxybenzene - Benzamide - Benzoic acid or derivatives - Tropane alkaloid - Anisole - Phenoxy compound - Benzonitrile - Benzoyl - Benzylamine - Phenol ether - Phenylmethylamine - Methoxybenzene - Aralkylamine - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Azacycle - Nitrile - Carbonitrile - Carboxylic acid derivative - Ether - Amine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Cyanide - Hydrocarbon derivative - Organic oxide - Hydrochloride - Organic oxygen compound - 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