(2R,3R,5R)-2-[(2R)-octan-2-yl]oxy-5-(phenylmethylsulfanyl)oxan-3-ol

Systemtic Name: (2R,3R,5R)-2-[(2R)-octan-2-yl]oxy-5-(phenylmethylsulfanyl)oxan-3-ol Openeye Name: (2R,3R,5R)-5-benzylsulfanyl-2-[(1R)-1-methylheptoxy]tetrahydropyran-3-ol CAS Name: (2R,3R,5R)-2-[(2R)-octan-2-yl]oxy-5-(phenylmethylthio)-3-oxanol IUPAC Name: (2R,3R,5R)-5-benzylsulfanyl-2-[(2R)-octan-2-yl]oxyoxan-3-ol Traditional Name: (2R,3R,5R)-5-(benzylthio)-2-[(1R)-1-methylheptoxy]tetrahydropyran-3-ol Formula: C20H32O3S MolecularWeight: 352.53128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1C(CC(CO1)SCC2=CC=CC=C2)O

Isomeric SMILES

CCCCCC[C@@H](C)O[C@@H]1[C@@H](C[C@H](CO1)SCC2=CC=CC=C2)O

InChI

InChI=1S/C20H32O3S/c1-3-4-5-7-10-16(2)23-20-19(21)13-18(14-22-20)24-15-17-11-8-6-9-12-17/h6,8-9,11-12,16,18-21H,3-5,7,10,13-15H2,1-2H3/t16-,18-,19-,20-/m1/s1