[3,4,5-triacetyloxy-6-(2-bromanylcyclohexyl)sulfanyl-oxan-2-yl]methyl ethanoate

Systemtic Name: [3,4,5-triacetyloxy-6-(2-bromanylcyclohexyl)sulfanyl-oxan-2-yl]methyl ethanoate Openeye Name: [3,4,5-triacetoxy-6-(2-bromocyclohexyl)sulfanyl-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [3,4,5-triacetyloxy-6-[(2-bromocyclohexyl)thio]-2-oxanyl]methyl ester IUPAC Name: [3,4,5-triacetyloxy-6-(2-bromocyclohexyl)sulfanyloxan-2-yl]methyl acetate Traditional Name: acetic acid [3,4,5-triacetoxy-6-[(2-bromocyclohexyl)thio]tetrahydropyran-2-yl]methyl ester Formula: C20H29BrO9S MolecularWeight: 525.40786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)SC2CCCCC2Br)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(C(O1)SC2CCCCC2Br)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C20H29BrO9S/c1-10(22)26-9-15-17(27-11(2)23)18(28-12(3)24)19(29-13(4)25)20(30-15)31-16-8-6-5-7-14(16)21/h14-20H,5-9H2,1-4H3