Compound Identification
SMILES
OC(=O)C([O-])=O.FC1=CC=C(C[NH+]2CCC(CCOC(C3=CC=C(F)C=C3)C3=CC=C(F)C=C3)CC2)C=C1
InChIKey
InChIKey=MKWCGGDBGMBBOY-UHFFFAOYSA-N
Formula
C29H30F3NO5
Mass
529.556
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
Diphenylmethanes Benzylethers Benzylamines Phenylmethylamines Aralkylamines Fluorobenzenes Aryl fluorides Dicarboxylic acids and derivatives Quaternary ammonium salts Trialkylamines Carboxylic acid salts Dialkyl ethers Carboxylic acids Azacyclic compounds Organic oxides Carbonyl compounds Organofluorides Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
Diphenylmethane - N-benzylpiperidine - Benzylether - Benzylamine - Phenylmethylamine - Aralkylamine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Quaternary ammonium salt - Carboxylic acid salt - Tertiary aliphatic amine - Tertiary amine - Azacycle - Carboxylic acid derivative - Ether - Carboxylic acid - Dialkyl ether - Organofluoride - Organohalogen compound - Amine - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organic cation - Aromatic heteromonocyclic 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