[(3S,5R,7S)-5,7-bis(methoxymethoxy)-9-oxidanyl-1-phenyl-1-phenylsulfanyl-nonan-3-yl] ethanoate

Systemtic Name: [(3S,5R,7S)-5,7-bis(methoxymethoxy)-9-oxidanyl-1-phenyl-1-phenylsulfanyl-nonan-3-yl] ethanoate Openeye Name: [(1S,3R,5S)-7-hydroxy-3,5-bis(methoxymethoxy)-1-(2-phenyl-2-phenylsulfanyl-ethyl)heptyl] acetate CAS Name: acetic acid [(3S,5R,7S)-9-hydroxy-5,7-bis(methoxymethoxy)-1-phenyl-1-(phenylthio)nonan-3-yl] ester IUPAC Name: [(3S,5R,7S)-9-hydroxy-5,7-bis(methoxymethoxy)-1-phenyl-1-phenylsulfanylnonan-3-yl] acetate Traditional Name: acetic acid [(1S,3R,5S)-7-hydroxy-3,5-bis(methoxymethoxy)-1-[2-phenyl-2-(phenylthio)ethyl]heptyl] ester Formula: C27H38O7S MolecularWeight: 506.65142

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CC(CC(CCO)OCOC)OCOC)CC(C1=CC=CC=C1)SC2=CC=CC=C2

Isomeric SMILES

CC(=O)O[C@@H](C[C@@H](C[C@H](CCO)OCOC)OCOC)CC(C1=CC=CC=C1)SC2=CC=CC=C2

InChI

InChI=1S/C27H38O7S/c1-21(29)34-25(17-24(33-20-31-3)16-23(14-15-28)32-19-30-2)18-27(22-10-6-4-7-11-22)35-26-12-8-5-9-13-26/h4-13,23-25,27-28H,14-20H2,1-3H3/t23-,24+,25-,27?/m0/s1