methyl (2R,3S,4S,5S,6S)-3,4,5-triacetyloxy-6-phenylsulfanyl-oxane-2-carboxylate

Systemtic Name: methyl (2R,3S,4S,5S,6S)-3,4,5-triacetyloxy-6-phenylsulfanyl-oxane-2-carboxylate Openeye Name: methyl (2R,3S,4S,5S,6S)-3,4,5-triacetoxy-6-phenylsulfanyl-tetrahydropyran-2-carboxylate CAS Name: (2R,3S,4S,5S,6S)-3,4,5-triacetyloxy-6-(phenylthio)-2-oxanecarboxylic acid methyl ester IUPAC Name: methyl (2R,3S,4S,5S,6S)-3,4,5-triacetyloxy-6-phenylsulfanyloxane-2-carboxylate Traditional Name: (2R,3S,4S,5S,6S)-3,4,5-triacetoxy-6-(phenylthio)tetrahydropyran-2-carboxylic acid methyl ester Formula: C19H22O9S MolecularWeight: 426.43758

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(OC(C1OC(=O)C)SC2=CC=CC=C2)C(=O)OC)OC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C19H22O9S/c1-10(20)25-14-15(26-11(2)21)17(27-12(3)22)19(28-16(14)18(23)24-4)29-13-8-6-5-7-9-13/h5-9,14-17,19H,1-4H3/t14-,15-,16+,17-,19-/m0/s1