[(2R,3S)-6-oxidanylidene-3-phenylmethoxy-2,3-dihydropyran-2-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [(2R,3S)-6-oxidanylidene-3-phenylmethoxy-2,3-dihydropyran-2-yl]methyl 4-methylbenzenesulfonate Openeye Name: [(2R,3S)-3-benzyloxy-6-oxo-2,3-dihydropyran-2-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2R,3S)-6-oxo-3-phenylmethoxy-2,3-dihydropyran-2-yl]methyl ester IUPAC Name: [(2R,3S)-6-oxo-3-phenylmethoxy-2,3-dihydropyran-2-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2R,3S)-3-benzoxy-6-keto-2,3-dihydropyran-2-yl]methyl ester Formula: C20H20O6S MolecularWeight: 388.4342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C=CC(=O)O2)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2[C@H](C=CC(=O)O2)OCC3=CC=CC=C3

InChI

InChI=1S/C20H20O6S/c1-15-7-9-17(10-8-15)27(22,23)25-14-19-18(11-12-20(21)26-19)24-13-16-5-3-2-4-6-16/h2-12,18-19H,13-14H2,1H3/t18-,19+/m0/s1