(2R,3S)-3-(Benzoyloxy)-2-(methoxycarbonyl)-8-azoniabicyclo[3.2.1]octane

ChemSpider ID: 23102789
Molecular Formula: C16H20NO4
Average mass: 290.333801 Da
Monoisotopic mass: 290.138672 Da
Systematic name

(2R,3S)-3-(Benzoyloxy)-2-(methoxycarbonyl)-8-azoniabicyclo[3.2.1]octane
SMILES and InChIs

SMILES:

COC(=O)[C@H]1[C@H](CC2CCC1[NH2+]2)OC(=O)c3ccccc3 Copied

Std. InChI:

InChI=1S/C16H19NO4/c1-20-16(19)14-12-8-7-11(17-12)9-13(14)21-15(18)10-5-3-2-4-6-10/h2-6,11-14,17H,7-9H2,1H3/p+1/t11?,12?,13-,14+/m0/s1 Copied

Std. InChIKey:

AYDBLCSLKNTEJL-CLRIEMFWSA-O Copied
Cite this record
CSID:23102789, http://www.chemspider.com/Chemical-Structure.23102789.html (accessed 08:10, May 25, 2012) Copied

Names and Identifiers

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