Structure Information
Structure

Compound Identification

SMILES

CC1=C(NC2=C(Cl)C=C(C=C2)C#N)N=CN=C1O[C@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC(O)(C(F)(F)F)C(F)(F)F

InChIKey

InChIKey=ASLBRZLKJWPYED-MUJYYYPQSA-N

Formula

C24H22ClF6N5O3

Mass

577.91

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Tropane alkaloids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Tropane alkaloids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-acyl-piperidine - Tropane alkaloid - N-acylpyrrolidine - Aniline or substituted anilines - Benzonitrile - Alkyl aryl ether - Aminopyrimidine - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Piperidine - Pyrimidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Tertiary alcohol - Pyrrolidine - Fluorohydrin - Carboxamide group - Halohydrin - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Nitrile - Carbonitrile - Alkyl halide - Organooxygen compound - Alkyl fluoride - Organic nitrogen compound - Carbonyl group - Alcohol - Hydrocarbon derivative - Organic oxide - Cyanide - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Amine - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as tropane alkaloids. These are organic compounds containing the nitrogenous bicyclic alkaloid parent N-Methyl-8-azabicyclo[3.2.1]octane.

External Descriptors

Not available

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