Compound Identification
SMILES
OC(=O)C(O)=O.CCSC1=CC(OC)=C(OC)C(=C1)C(=O)NC1CC2CCC(C1)N2CC1=CC=CC=C1
InChIKey
InChIKey=RLKJUTOUVWCAIJ-UHFFFAOYSA-N
Formula
C27H34N2O7S
Mass
530.64
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 M-sulfanylbenzoic acids and derivatives Benzamides Tropane alkaloids Phenylmethylamines Phenoxy compounds Thiophenol ethers Anisoles Benzylamines Benzoyl derivatives Alkylarylthioethers Aralkylamines Alkyl aryl ethers N-alkylpyrrolidines Dicarboxylic acids and derivatives Secondary carboxylic acid amides Trialkylamines Amino acids and derivatives Sulfenyl compounds Carboxylic acids Azacyclic compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
N-benzylpiperidine - O-dimethoxybenzene - Dimethoxybenzene - M-sulfanylbenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Tropane alkaloid - Anisole - Phenoxy compound - Aryl thioether - Benzoyl - Benzylamine - Methoxybenzene - Phenol ether - Phenylmethylamine - Thiophenol ether - Alkyl aryl ether - Aralkylamine - Alkylarylthioether - N-alkylpyrrolidine - Benzenoid - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Pyrrolidine - Tertiary amine - Secondary carboxylic acid amide - Tertiary aliphatic amine - Carboxamide group - Amino acid or derivatives - Sulfenyl compound - Thioether - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Carbonyl group - Organonitrogen compound - Organic nitrogen compound - Amine - 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