Compound Identification
SMILES
OC(=O)C1=CC=CC2=C1C=CC(SCC(=O)NC1CCN(CC3=CC=C(Cl)C=C3)CC1)=C2
InChIKey
InChIKey=QEZXMGVIZDVOFR-UHFFFAOYSA-N
Formula
C25H25ClN2O3S
Mass
469.0
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
Naphthalenecarboxylic acids Thiophenol ethers Phenylmethylamines Benzylamines Alkylarylthioethers Aralkylamines Chlorobenzenes Aryl chlorides Trialkylamines Secondary carboxylic acid amides Amino acids Sulfenyl compounds Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Organochlorides Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalenecarboxylic acid or derivatives - 1-naphthalenecarboxylic acid - N-benzylpiperidine - Naphthalene - Aryl thioether - Benzylamine - Phenylmethylamine - Thiophenol ether - Halobenzene - Aralkylamine - Alkylarylthioether - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Amino acid - Amino acid or derivatives - Secondary carboxylic acid amide - Tertiary amine - Carboxamide group - Tertiary aliphatic amine - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Carboxylic acid - Thioether - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen 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