(R)-2-(4-fluoro-phenylamino)-2-phenyl-acetoxyl-1-(2-oxo-2-thiophen-2-yl-ethyl)-1-azonia-bicyclo[2.2.2]octane chloride

HCID 86643238
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Basic information

Standard SMILES
O=C(C[N+]12CCC(CC1)C[C@H]2OC(=O)C(Nc1ccc(F)cc1)c1ccccc1)c1cccs1.[Cl-]
InChIKey
OBGWJKNREZVMEU-ADLKUGIXSA-M
Molecular formula
C27H28ClFN2O3S
Average molar mass
515 g/mol
Monoisotopic mass
514.1493198

Names & identifiers

Preferred name
(R)-2-(4-fluoro-phenylamino)-2-phenyl-acetoxyl-1-(2-oxo-2-thiophen-2-yl-ethyl)-1-azonia-bicyclo[2.2.2]octane chloride
IUPAC
[(2R)-1-(2-oxo-2-thiophen-2-ylethyl)-1-azoniabicyclo[2.2.2]octan-2-yl] 2-(4-fluoroanilino)-2-phenylacetate chloride

Names & synonyms

OBGWJKNREZVMEU-ADLKUGIXSA-M(R)-2-(4-fluoro-phenylamino)-2-phenyl-acetoxyl-1-(2-oxo-2-thiophen-2-yl-ethyl)-1-azonia-bicyclo[2.2.2]octane chloride

Database identifiers

PubChem CID
86643238

Properties

Computed structural properties

Topological polar surface area
83.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
9
Heavy atoms
35

Related reactions

1 records
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Compound notes

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