[4,5-bis(2,2-dimethylpropanoyloxy)-2-methyl-6-oxidanyl-6-(phenylsulfinyl)oxan-3-yl] 2,2-dimethylpropanoate

Systemtic Name: [4,5-bis(2,2-dimethylpropanoyloxy)-2-methyl-6-oxidanyl-6-(phenylsulfinyl)oxan-3-yl] 2,2-dimethylpropanoate Openeye Name: [6-(benzenesulfinyl)-4,5-bis(2,2-dimethylpropanoyloxy)-6-hydroxy-2-methyl-tetrahydropyran-3-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [6-(benzenesulfinyl)-4,5-bis(2,2-dimethyl-1-oxopropoxy)-6-hydroxy-2-methyl-3-oxanyl] ester IUPAC Name: [6-(benzenesulfinyl)-4,5-bis(2,2-dimethylpropanoyloxy)-6-hydroxy-2-methyloxan-3-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [6-(benzenesulfinyl)-6-hydroxy-2-methyl-4,5-dipivaloyloxy-tetrahydropyran-3-yl] ester Formula: C27H40O9S MolecularWeight: 540.6661

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)(O)S(=O)C2=CC=CC=C2)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C

Isomeric SMILES

CC1C(C(C(C(O1)(O)S(=O)C2=CC=CC=C2)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C

InChI

InChI=1S/C27H40O9S/c1-16-18(33-21(28)24(2,3)4)19(34-22(29)25(5,6)7)20(35-23(30)26(8,9)10)27(31,36-16)37(32)17-14-12-11-13-15-17/h11-16,18-20,31H,1-10H3