Structure Information
Structure

Compound Identification

SMILES

CNCC(=O)C[C@@]1(O)C(=O)N(C2CCN(CC2)[C@@H]2[C@@H](O)C3=CC=CC4=C3C2=CC=C4)C2=CC=CC=C12

InChIKey

InChIKey=XKFJMYUMFOYPKG-YCVJPRETSA-N

Formula

C29H31N3O4

Mass

485.584

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Piperidines

Subclass

Fentanyls

Intermediate Tree Nodes

Not available

Direct Parent

Fentanyls

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Fentanyl - Delta amino acid or derivatives - Naphthalene - Indole or derivatives - Aralkylamine - Beta-hydroxy ketone - Benzenoid - Alpha-aminoketone - Tertiary carboxylic acid amide - Tertiary alcohol - 1,2-aminoalcohol - Amino acid or derivatives - Carboxamide group - Ketone - Lactam - Tertiary aliphatic amine - Secondary alcohol - Tertiary amine - Azacycle - Secondary aliphatic amine - Carboxylic acid derivative - Secondary amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Amine - Alcohol - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as fentanyls. These are compounds containing the fentanyl moiety or a derivative, which is based on a N-(1-(2-phenylethyl)-4-piperidinyl)-N-phenylpropanamide skeleton.

External Descriptors

Not available

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