(7,7-dimethoxy-3-bicyclo[2.2.1]heptanyl) 4-methylbenzenesulfonate

Systemtic Name: (7,7-dimethoxy-3-bicyclo[2.2.1]heptanyl) 4-methylbenzenesulfonate Openeye Name: (7,7-dimethoxynorbornan-2-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (7,7-dimethoxy-3-bicyclo[2.2.1]heptanyl) ester IUPAC Name: (7,7-dimethoxy-3-bicyclo[2.2.1]heptanyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (7,7-dimethoxynorbornan-2-yl) ester Formula: C16H22O5S MolecularWeight: 326.40788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC3CCC2C3(OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CC3CCC2C3(OC)OC

InChI

InChI=1S/C16H22O5S/c1-11-4-7-13(8-5-11)22(17,18)21-15-10-12-6-9-14(15)16(12,19-2)20-3/h4-5,7-8,12,14-15H,6,9-10H2,1-3H3