[6,6-bis(ethylsulfanyl)-5-oxidanyl-3,4-bis(phenylcarbonyloxy)-1-phenylmethoxy-hexan-2-yl] benzoate

Systemtic Name: [6,6-bis(ethylsulfanyl)-5-oxidanyl-3,4-bis(phenylcarbonyloxy)-1-phenylmethoxy-hexan-2-yl] benzoate Openeye Name: [2,3-dibenzoyloxy-1-(benzyloxymethyl)-5,5-bis(ethylsulfanyl)-4-hydroxy-pentyl] benzoate CAS Name: benzoic acid [3,4-dibenzoyloxy-6,6-bis(ethylthio)-5-hydroxy-1-phenylmethoxyhexan-2-yl] ester IUPAC Name: [3,4-dibenzoyloxy-6,6-bis(ethylsulfanyl)-5-hydroxy-1-phenylmethoxyhexan-2-yl] benzoate Traditional Name: benzoic acid [1-(benzoxymethyl)-2,3-dibenzoyloxy-5,5-bis(ethylthio)-4-hydroxy-pentyl] ester Formula: C38H40O8S2 MolecularWeight: 688.8494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(C(C(C(C(COCC1=CC=CC=C1)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)O)SCC

Isomeric SMILES

CCSC(C(C(C(C(COCC1=CC=CC=C1)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)O)SCC

InChI

InChI=1S/C38H40O8S2/c1-3-47-38(48-4-2)32(39)34(46-37(42)30-23-15-8-16-24-30)33(45-36(41)29-21-13-7-14-22-29)31(26-43-25-27-17-9-5-10-18-27)44-35(40)28-19-11-6-12-20-28/h5-24,31-34,38-39H,3-4,25-26H2,1-2H3