[(2R,3R,6R)-3-acetyloxy-6-(4-bromophenyl)sulfanyl-3,6-dihydro-2H-pyran-2-yl]methyl ethanoate

Systemtic Name: [(2R,3R,6R)-3-acetyloxy-6-(4-bromophenyl)sulfanyl-3,6-dihydro-2H-pyran-2-yl]methyl ethanoate Openeye Name: [(2R,3R,6R)-3-acetoxy-6-(4-bromophenyl)sulfanyl-3,6-dihydro-2H-pyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,6R)-3-acetyloxy-6-[(4-bromophenyl)thio]-3,6-dihydro-2H-pyran-2-yl]methyl ester IUPAC Name: [(2R,3R,6R)-3-acetyloxy-6-(4-bromophenyl)sulfanyl-3,6-dihydro-2H-pyran-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,6R)-3-acetoxy-6-[(4-bromophenyl)thio]-3,6-dihydro-2H-pyran-2-yl]methyl ester Formula: C16H17BrO5S MolecularWeight: 401.27218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C=CC(O1)SC2=CC=C(C=C2)Br)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@@H](C=C[C@H](O1)SC2=CC=C(C=C2)Br)OC(=O)C

InChI

InChI=1S/C16H17BrO5S/c1-10(18)20-9-15-14(21-11(2)19)7-8-16(22-15)23-13-5-3-12(17)4-6-13/h3-8,14-16H,9H2,1-2H3/t14-,15-,16-/m1/s1