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9-{2-[2-Hydroxy(diphenyl)acetoxy]ethyl}-9-azoniabicyclo[3.3.1]nonane chloride

ChemSpider ID: 52490
Molecular Formula: C₂₄H₃₀ClNO₃
Average mass: 415.952911 Da
Monoisotopic mass: 415.191437 Da
Systematic name

9-{2-[2-Hydroxy(diphenyl)acetoxy]ethyl}-9-azoniabicyclo[3.3.1]nonane chloride
SMILES and InChIs

SMILES:

[Cl-].O=C(OCC[NH+]1C2CCCC1CCC2)C(O)(c3ccccc3)c4ccccc4 Copied

Std. InChI:

InChI=1S/C24H29NO3.ClH/c26-23(28-18-17-25-21-13-7-14-22(25)16-8-15-21)24(27,19-9-3-1-4-10-19)20-11-5-2-6-12-20;/h1-6,9-12,21-22,27H,7-8,13-18H2;1H Copied

Std. InChIKey:

ISBRXSCJVBOSHD-UHFFFAOYSA-N Copied
Cite this record
CSID:52490, http://www.chemspider.com/Chemical-Structure.52490.html (accessed 11:46, May 22, 2013) Copied

Validated by Experts, Validated by Users, Non-Validated, Removed by Users, Redirected by Users, Redirect Approved by Experts

101377-89-3 [RN]

9-(2-{[hydroxy(diphenyl)acetyl]oxy}ethyl)-9-azoniabicyclo[3.3.1]nonane chloride

9-Azabicyclo(3.3.1)nonane-9-ethanol, benzilate (ester), hydrochloride

Benzilate ester of N-(β-hydroxyethyl)norgranatane hydrochloride

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

Click to predict properties on the Chemicalize site

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