Compound Identification
SMILES
CO[C@@]1(CN2CCC1CC2)C#CC(O)(C1=CC=CC=C1)C1=C(F)N=CC=C1
InChIKey
InChIKey=RTMQZXMBCBMCJK-ZMFCMNQTSA-N
Formula
C22H23FN2O2
Mass
366.436
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Quinuclidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinuclidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Quinuclidines
Alternative Parents
2-halopyridines Ynones Piperidines Benzene and substituted derivatives Aryl fluorides Tertiary alcohols Heteroaromatic compounds Trialkylamines Dialkyl ethers Azacyclic compounds Organofluorides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinuclidine - 2-halopyridine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Piperidine - Benzenoid - Pyridine - Ynone - Heteroaromatic compound - Tertiary alcohol - Tertiary aliphatic amine - Tertiary amine - Dialkyl ether - Ether - Azacycle - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Aromatic alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as quinuclidines. These are compounds containing a 1-azabicyclo[2.2.2]octane moiety.
External Descriptors
Not available