(2S,5R)-2-phenylsulfanyl-6,8-dioxabicyclo[3.2.1]octan-4-one

Systemtic Name: (2S,5R)-2-phenylsulfanyl-6,8-dioxabicyclo[3.2.1]octan-4-one Openeye Name: (2S,5R)-2-phenylsulfanyl-6,8-dioxabicyclo[3.2.1]octan-4-one CAS Name: (2S,5R)-2-(phenylthio)-6,8-dioxabicyclo[3.2.1]octan-4-one IUPAC Name: (2S,5R)-2-phenylsulfanyl-6,8-dioxabicyclo[3.2.1]octan-4-one Traditional Name: (2S,5R)-2-(phenylthio)-6,8-dioxabicyclo[3.2.1]octan-4-one Formula: C12H12O3S MolecularWeight: 236.28688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C2COC(C1=O)O2)SC3=CC=CC=C3

Isomeric SMILES

C1[C@@H](C2CO[C@@H](C1=O)O2)SC3=CC=CC=C3

InChI

InChI=1S/C12H12O3S/c13-9-6-11(10-7-14-12(9)15-10)16-8-4-2-1-3-5-8/h1-5,10-12H,6-7H2/t10?,11-,12+/m0/s1