6-methoxy-2-phenyl-8-(phenylmethylsulfanyl)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-ol

Systemtic Name: 6-methoxy-2-phenyl-8-(phenylmethylsulfanyl)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-ol Openeye Name: 8-benzylsulfanyl-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-ol CAS Name: 6-methoxy-2-phenyl-8-(phenylmethylthio)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-ol IUPAC Name: 8-benzylsulfanyl-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-ol Traditional Name: 8-(benzylthio)-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-ol Formula: C21H24O5S MolecularWeight: 388.47726

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(C2C(O1)COC(O2)C3=CC=CC=C3)SCC4=CC=CC=C4)O

Isomeric SMILES

COC1C(C(C2C(O1)COC(O2)C3=CC=CC=C3)SCC4=CC=CC=C4)O

InChI

InChI=1S/C21H24O5S/c1-23-21-17(22)19(27-13-14-8-4-2-5-9-14)18-16(25-21)12-24-20(26-18)15-10-6-3-7-11-15/h2-11,16-22H,12-13H2,1H3