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

Systemtic Name: [3,4,5-triacetyloxy-6-(4-bromophenyl)sulfonyl-oxan-2-yl]methyl ethanoate Openeye Name: [3,4,5-triacetoxy-6-(4-bromophenyl)sulfonyl-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [3,4,5-triacetyloxy-6-(4-bromophenyl)sulfonyl-2-oxanyl]methyl ester IUPAC Name: [3,4,5-triacetyloxy-6-(4-bromophenyl)sulfonyloxan-2-yl]methyl acetate Traditional Name: acetic acid (3,4,5-triacetoxy-6-brosyl-tetrahydropyran-2-yl)methyl ester Formula: C20H23BrO11S MolecularWeight: 551.35902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)S(=O)(=O)C2=CC=C(C=C2)Br)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(C(O1)S(=O)(=O)C2=CC=C(C=C2)Br)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C20H23BrO11S/c1-10(22)28-9-16-17(29-11(2)23)18(30-12(3)24)19(31-13(4)25)20(32-16)33(26,27)15-7-5-14(21)6-8-15/h5-8,16-20H,9H2,1-4H3