Compound Identification
SMILES
ClC1=CC=C(C=C1)C(=O)N[C@H]1CN2CCC1CC2.COC1=C(OC)C=C2C(=O)C(CC3CCN(CC4=CC=CC=C4)CC3)CC2=C1
InChIKey
InChIKey=MAFVMVFMMDAQAK-RSJBZBQMSA-N
Formula
C38H46ClN3O4
Mass
644.25
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
Indanones 4-halobenzoic acids and derivatives Benzamides Anisoles Aryl alkyl ketones Benzoyl derivatives Benzylamines Quinuclidines Phenylmethylamines Chlorobenzenes Aralkylamines Alkyl aryl ethers Aryl chlorides Trialkylamines Amino acids and derivatives Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Not available
Substituents
N-benzylpiperidine - Indanone - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Indane - Anisole - Benzoyl - Benzylamine - Phenol ether - Phenylmethylamine - Quinuclidine - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Aralkylamine - Chlorobenzene - Halobenzene - Benzenoid - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Ketone - Carboxylic acid derivative - Azacycle - Ether - Organic nitrogen compound - Organonitrogen compound - Amine - Organic oxygen compound - Organohalogen compound - Organochloride - Organooxygen compound - Organic oxide - Hydrocarbon derivative - 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