(3-cyano-1-azabicyclo[2.2.2]octan-3-yl) methanesulfonate

Systemtic Name: (3-cyano-1-azabicyclo[2.2.2]octan-3-yl) methanesulfonate Openeye Name: (3-cyanoquinuclidin-3-yl) methanesulfonate CAS Name: methanesulfonic acid (3-cyano-1-azabicyclo[2.2.2]octan-3-yl) ester IUPAC Name: (3-cyano-1-azabicyclo[2.2.2]octan-3-yl) methanesulfonate Traditional Name: methanesulfonic acid (3-cyanoquinuclidin-3-yl) ester Formula: C9H14N2O3S MolecularWeight: 230.28406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1(CN2CCC1CC2)C#N

Isomeric SMILES

CS(=O)(=O)OC1(CN2CCC1CC2)C#N

InChI

InChI=1S/C9H14N2O3S/c1-15(12,13)14-9(6-10)7-11-4-2-8(9)3-5-11/h8H,2-5,7H2,1H3