[(5R,8R,10S)-3-oxidanylidene-8-prop-1-en-2-yl-4-oxaspiro[4.5]decan-10-yl] 4-methylbenzenesulfonate

Systemtic Name: [(5R,8R,10S)-3-oxidanylidene-8-prop-1-en-2-yl-4-oxaspiro[4.5]decan-10-yl] 4-methylbenzenesulfonate Openeye Name: [(5R,8R,10S)-8-isopropenyl-3-oxo-4-oxaspiro[4.5]decan-10-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(5R,8R,10S)-8-(1-methylethenyl)-3-oxo-4-oxaspiro[4.5]decan-10-yl] ester IUPAC Name: [(5R,8R,10S)-3-oxo-8-prop-1-en-2-yl-4-oxaspiro[4.5]decan-10-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(5R,8R,10S)-8-isopropenyl-3-keto-4-oxaspiro[4.5]decan-10-yl] ester Formula: C19H24O5S MolecularWeight: 364.45586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(CCC23CCC(=O)O3)C(=C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@H]2C[C@@H](CC[C@@]23CCC(=O)O3)C(=C)C

InChI

InChI=1S/C19H24O5S/c1-13(2)15-8-10-19(11-9-18(20)23-19)17(12-15)24-25(21,22)16-6-4-14(3)5-7-16/h4-7,15,17H,1,8-12H2,2-3H3/t15-,17+,19-/m1/s1