cyanomethyl (7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl)methanesulfonate

Systemtic Name: cyanomethyl (7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl)methanesulfonate Openeye Name: cyanomethyl (7,7-dimethyl-2-oxo-norbornan-1-yl)methanesulfonate CAS Name: (7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)methanesulfonic acid cyanomethyl ester IUPAC Name: cyanomethyl (7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)methanesulfonate Traditional Name: (2-keto-7,7-dimethyl-norbornan-1-yl)methanesulfonic acid cyanomethyl ester Formula: C12H17NO4S MolecularWeight: 271.33268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(=O)C2)CS(=O)(=O)OCC#N)C

Isomeric SMILES

CC1(C2CCC1(C(=O)C2)CS(=O)(=O)OCC#N)C

InChI

InChI=1S/C12H17NO4S/c1-11(2)9-3-4-12(11,10(14)7-9)8-18(15,16)17-6-5-13/h9H,3-4,6-8H2,1-2H3