[(2S,3S,4S)-2-acetyloxy-4-fluoranyl-3-(phenylcarbonyloxy)thiolan-2-yl]methyl benzoate

Systemtic Name: [(2S,3S,4S)-2-acetyloxy-4-fluoranyl-3-(phenylcarbonyloxy)thiolan-2-yl]methyl benzoate Openeye Name: [(2S,3S,4S)-2-acetoxy-3-benzoyloxy-4-fluoro-tetrahydrothiophen-2-yl]methyl benzoate CAS Name: benzoic acid [(2S,3S,4S)-2-acetyloxy-3-benzoyloxy-4-fluoro-2-thiolanyl]methyl ester IUPAC Name: [(2S,3S,4S)-2-acetyloxy-3-benzoyloxy-4-fluorothiolan-2-yl]methyl benzoate Traditional Name: benzoic acid [(2S,3S,4S)-2-acetoxy-3-benzoyloxy-4-fluoro-tetrahydrothiophen-2-yl]methyl ester Formula: C21H19FO6S MolecularWeight: 418.435363

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(C(C(CS1)F)OC(=O)C2=CC=CC=C2)COC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)O[C@@]1([C@H]([C@@H](CS1)F)OC(=O)C2=CC=CC=C2)COC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H19FO6S/c1-14(23)28-21(13-26-19(24)15-8-4-2-5-9-15)18(17(22)12-29-21)27-20(25)16-10-6-3-7-11-16/h2-11,17-18H,12-13H2,1H3/t17-,18+,21+/m1/s1