[(2R,3R,4R,6S)-6-methoxy-2-methyl-4-(4-methylphenyl)sulfonyloxy-oxan-3-yl] benzoate

Systemtic Name: [(2R,3R,4R,6S)-6-methoxy-2-methyl-4-(4-methylphenyl)sulfonyloxy-oxan-3-yl] benzoate Openeye Name: [(2R,3R,4R,6S)-6-methoxy-2-methyl-4-(p-tolylsulfonyloxy)tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [(2R,3R,4R,6S)-6-methoxy-2-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxanyl] ester IUPAC Name: [(2R,3R,4R,6S)-6-methoxy-2-methyl-4-(4-methylphenyl)sulfonyloxyoxan-3-yl] benzoate Traditional Name: benzoic acid [(2R,3R,4R,6S)-6-methoxy-2-methyl-4-tosyloxy-tetrahydropyran-3-yl] ester Formula: C21H24O7S MolecularWeight: 420.47606

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(O1)OC)OS(=O)(=O)C2=CC=C(C=C2)C)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@@H]1[C@H]([C@@H](C[C@H](O1)OC)OS(=O)(=O)C2=CC=C(C=C2)C)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24O7S/c1-14-9-11-17(12-10-14)29(23,24)28-18-13-19(25-3)26-15(2)20(18)27-21(22)16-7-5-4-6-8-16/h4-12,15,18-20H,13H2,1-3H3/t15-,18-,19+,20-/m1/s1