Compound Identification
SMILES
COC1=CC=C(CNC2=CN=C3O[C@@]4(CC3=C2)CN2CCC4CC2)C=C1
InChIKey
InChIKey=JCYITCBBIMAJNK-NRFANRHFSA-N
Formula
C21H25N3O2
Mass
351.45
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
Phenylmethylamines Phenoxy compounds Methoxybenzenes Benzylamines Anisoles Secondary alkylarylamines Aralkylamines Aminopyridines and derivatives Alkyl aryl ethers Piperidines Heteroaromatic compounds Trialkylamines Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Anisole - Benzylamine - Phenol ether - Phenylmethylamine - Quinuclidine - Methoxybenzene - Phenoxy compound - Aralkylamine - Secondary aliphatic/aromatic amine - Aminopyridine - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Pyridine - Piperidine - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Secondary amine - Oxacycle - Azacycle - Ether - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - 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