Compound Identification
SMILES
OC(C(=O)O[C@H]1C[N+]2(CC=C)CCC1CC2)(C1=CC=CO1)C1=CC=CC=C1
InChIKey
InChIKey=CRBATYOTNVGWRF-ONVZLNGMSA-N
Formula
C22H26NO4
Mass
368.452
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
Piperidines Benzene and substituted derivatives Tetraalkylammonium salts Tertiary alcohols Furans Heteroaromatic compounds Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Amines Hydrocarbon derivatives Carbonyl compounds Organic oxides Organopnictogen compounds Aromatic alcohols Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinuclidine - Monocyclic benzene moiety - Piperidine - Benzenoid - Furan - Quaternary ammonium salt - Tetraalkylammonium salt - Heteroaromatic compound - Tertiary alcohol - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Oxacycle - Monocarboxylic acid or derivatives - Amine - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Aromatic alcohol - Carbonyl group - Organic cation - 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