Compound Identification
SMILES
OC(=O)\C=C/C(O)=O.ClC1=CC=C(CN2CCC3SC(=O)C=C3C2)C=C1
InChIKey
InChIKey=CMSKLIXIUTXEJH-BTJKTKAUSA-N
Formula
C18H18ClNO5S
Mass
395.85
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
Thienopyridines Benzylamines Phenylmethylamines Aralkylamines Chlorobenzenes Unsaturated fatty acids Aryl chlorides Dicarboxylic acids and derivatives Dihydrothiophenes Carbothioic S-lactones Amino acids and derivatives Thioesters Trialkylamines Carboxylic acids Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Not available
Substituents
N-benzylpiperidine - Thienopyridine - Phenylmethylamine - Benzylamine - Halobenzene - Chlorobenzene - Aralkylamine - Aryl chloride - Dicarboxylic acid or derivatives - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Unsaturated fatty acid - Fatty acid - Benzenoid - Carbothioic s-lactone - 2,5-dihydrothiophene - Thiocarboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Carboxylic acid - Thiocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organic oxide - 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