[(2R,3R)-1-methoxy-1,4-bis(oxidanylidene)-2-(phenylcarbonyloxy)-5-phenylsulfanyl-pentan-3-yl] benzoate

Systemtic Name: [(2R,3R)-1-methoxy-1,4-bis(oxidanylidene)-2-(phenylcarbonyloxy)-5-phenylsulfanyl-pentan-3-yl] benzoate Openeye Name: [(1R,2R)-2-benzoyloxy-3-methoxy-3-oxo-1-(2-phenylsulfanylacetyl)propyl] benzoate CAS Name: benzoic acid [(2R,3R)-2-benzoyloxy-1-methoxy-1,4-dioxo-5-(phenylthio)pentan-3-yl] ester IUPAC Name: [(2R,3R)-2-benzoyloxy-1-methoxy-1,4-dioxo-5-phenylsulfanylpentan-3-yl] benzoate Traditional Name: benzoic acid [(1R,2R)-2-benzoyloxy-3-keto-3-methoxy-1-[2-(phenylthio)acetyl]propyl] ester Formula: C26H22O7S MolecularWeight: 478.51368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C(=O)CSC1=CC=CC=C1)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@@H]([C@H](C(=O)CSC1=CC=CC=C1)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H22O7S/c1-31-26(30)23(33-25(29)19-13-7-3-8-14-19)22(32-24(28)18-11-5-2-6-12-18)21(27)17-34-20-15-9-4-10-16-20/h2-16,22-23H,17H2,1H3/t22-,23+/m0/s1