Compound Identification
SMILES
[O-]C(=O)C(F)(F)F.OC(C(=O)O[C@H]1C[N+]2(CCCC3OCCO3)CCC1CC2)(C1=CC=CS1)C1=CC=CS1
InChIKey
InChIKey=UCFILGOEDYCMDV-SPVPNRHKSA-M
Formula
C25H30F3NO7S2
Mass
577.63
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 Thiophenes Tetraalkylammonium salts Tertiary alcohols 1,3-dioxolanes Alpha-halocarboxylic acids Heteroaromatic compounds Carboxylic acid esters Carboxylic acid salts Oxacyclic compounds Acetals Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Organic oxides Aromatic alcohols Amines Organic zwitterions Alkyl fluorides Organofluorides Organopnictogen compounds
Molecular Framework
Not available
Substituents
Quinuclidine - Piperidine - Meta-dioxolane - Quaternary ammonium salt - Tertiary alcohol - Thiophene - Heteroaromatic compound - Tetraalkylammonium salt - Alpha-halocarboxylic acid or derivatives - Alpha-halocarboxylic acid - Carboxylic acid ester - Carboxylic acid salt - Azacycle - Oxacycle - Acetal - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carboxylic acid - Organic nitrogen compound - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Aromatic alcohol - Organic zwitterion - Hydrocarbon derivative - Carbonyl group - Amine - Organic oxide - Organopnictogen compound - Alkyl halide - Alkyl fluoride - Alcohol - Organic oxygen 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