Basic information
- CAS
73924-73-9- Standard SMILES
C/C(=C1\C[NH+]2CCC1CC2CO)c1cc[nH+]c2ccc(OCCO)cc12.[Cl-].[Cl-]- InChIKey
AWYXBLDGYZQFPC-MUYPCZNDSA-N- Molecular formula
- C21H28Cl2N2O3
- Average molar mass
- 427.4 g/mol
- Monoisotopic mass
- 426.1476981
Names & identifiers
- Preferred name
- 1-Azabicyclo(2.2.2)octane-2-methanol, 5-ethylidene-alpha-(6-(2-hydroxyethoxy)-4-quinolyl)-, dihydrochloride
- IUPAC
- 2-[4-[(1E)-1-[6-(hydroxymethyl)-1-azoniabicyclo[2.2.2]octan-3-ylidene]ethyl]quinolin-1-ium-6-yl]oxyethanol dichloride
Names & synonyms
1-Azabicyclo(2.2.2)octane-2-methanol, 5-ethylidene-alpha-(6-(2-hydroxyethoxy)-4-quinolyl)-, dihydrochloride73924-73-9
Database identifiers
- CAS
73924-73-9- PubChem CID
- 5361998
Properties
Computed structural properties
- Topological polar surface area
- 68.3 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 523
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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