[(2R,3R,5S,6R)-6-methyl-5-phenylmethoxy-2-phenylsulfanyl-oxan-3-yl] 2,2-dimethylpropanoate

Systemtic Name: [(2R,3R,5S,6R)-6-methyl-5-phenylmethoxy-2-phenylsulfanyl-oxan-3-yl] 2,2-dimethylpropanoate Openeye Name: [(2R,3R,5S,6R)-5-benzyloxy-6-methyl-2-phenylsulfanyl-tetrahydropyran-3-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(2R,3R,5S,6R)-6-methyl-5-phenylmethoxy-2-(phenylthio)-3-oxanyl] ester IUPAC Name: [(2R,3R,5S,6R)-6-methyl-5-phenylmethoxy-2-phenylsulfanyloxan-3-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(2R,3R,5S,6R)-5-benzoxy-6-methyl-2-(phenylthio)tetrahydropyran-3-yl] ester Formula: C24H30O4S MolecularWeight: 414.5576

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC(C(O1)SC2=CC=CC=C2)OC(=O)C(C)(C)C)OCC3=CC=CC=C3

Isomeric SMILES

C[C@@H]1[C@H](C[C@H]([C@H](O1)SC2=CC=CC=C2)OC(=O)C(C)(C)C)OCC3=CC=CC=C3

InChI

InChI=1S/C24H30O4S/c1-17-20(26-16-18-11-7-5-8-12-18)15-21(28-23(25)24(2,3)4)22(27-17)29-19-13-9-6-10-14-19/h5-14,17,20-22H,15-16H2,1-4H3/t17-,20+,21-,22-/m1/s1