[(4S,5R)-4-[(4S)-5-oxidanylidene-2-phenyl-1,3-dioxan-4-yl]-2-phenyl-1,3-dioxan-5-yl] 4-methylbenzenesulfonate

Systemtic Name: [(4S,5R)-4-[(4S)-5-oxidanylidene-2-phenyl-1,3-dioxan-4-yl]-2-phenyl-1,3-dioxan-5-yl] 4-methylbenzenesulfonate Openeye Name: [(4S,5R)-4-[(4S)-5-oxo-2-phenyl-1,3-dioxan-4-yl]-2-phenyl-1,3-dioxan-5-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(4S,5R)-4-[(4S)-5-oxo-2-phenyl-1,3-dioxan-4-yl]-2-phenyl-1,3-dioxan-5-yl] ester IUPAC Name: [(4S,5R)-4-[(4S)-5-oxo-2-phenyl-1,3-dioxan-4-yl]-2-phenyl-1,3-dioxan-5-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(4S,5R)-4-[(4S)-5-keto-2-phenyl-1,3-dioxan-4-yl]-2-phenyl-1,3-dioxan-5-yl] ester Formula: C27H26O8S MolecularWeight: 510.55554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2COC(OC2C3C(=O)COC(O3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@@H]2COC(O[C@H]2[C@H]3C(=O)COC(O3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H26O8S/c1-18-12-14-21(15-13-18)36(29,30)35-23-17-32-27(20-10-6-3-7-11-20)34-25(23)24-22(28)16-31-26(33-24)19-8-4-2-5-9-19/h2-15,23-27H,16-17H2,1H3/t23-,24-,25-,26?,27?/m1/s1