Compound Identification
SMILES
COC1=C(O)C=C(C=C1)C1C2=CCC3C(C2CC2C(=O)N(C(=O)C12C)C1=CC(=NN1C)C1=C(C)C2=C(S1)C=CC(Cl)=C2)C(=O)N(C1CCN(CC2=CC=CC=C2)CC1)C3=O
InChIKey
InChIKey=RZPONDNWKWHZCF-UHFFFAOYSA-N
Formula
C47H46ClN5O6S
Mass
844.42
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
Cyclohexylphenols Isoindolones Methoxyphenols 1-benzothiophenes Anisoles Benzylamines Phenylmethylamines Phenoxy compounds Methoxybenzenes Aralkylamines Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Pyrrolidine-2-ones Aryl chlorides N-substituted carboxylic acid imides N-alkylpyrrolidines Pyrazoles Heteroaromatic compounds Dicarboximides Thiophenes Amino acids and derivatives Trialkylamines Lactams Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclohexylphenol - N-benzylpiperidine - Isoindolone - Methoxyphenol - Isoindole or derivatives - Isoindoline - Benzothiophene - 1-benzothiophene - Phenol ether - Methoxybenzene - Phenylmethylamine - Benzylamine - Phenoxy compound - Anisole - Alkyl aryl ether - Aralkylamine - Phenol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Carboxylic acid imide, n-substituted - Azole - Heteroaromatic compound - Carboxylic acid imide - Thiophene - Dicarboximide - Pyrrolidine - Pyrazole - Lactam - Tertiary aliphatic amine - Amino acid or derivatives - Tertiary amine - Carboxylic acid derivative - Azacycle - Ether - Organonitrogen compound - Carbonyl group - Organochloride - Amine - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organic oxygen compound - Organooxygen 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