S-tert-butyl 2-[(2R,3S,6R)-3-phenylmethoxy-6-[(E)-prop-1-enyl]oxan-2-yl]ethanethioate

Systemtic Name: S-tert-butyl 2-[(2R,3S,6R)-3-phenylmethoxy-6-[(E)-prop-1-enyl]oxan-2-yl]ethanethioate Openeye Name: S-tert-butyl 2-[(2R,3S,6R)-3-benzyloxy-6-[(E)-prop-1-enyl]tetrahydropyran-2-yl]ethanethioate CAS Name: 2-[(2R,3S,6R)-3-phenylmethoxy-6-[(E)-prop-1-enyl]-2-oxanyl]ethanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl 2-[(2R,3S,6R)-3-phenylmethoxy-6-[(E)-prop-1-enyl]oxan-2-yl]ethanethioate Traditional Name: 2-[(2R,3S,6R)-3-benzoxy-6-[(E)-prop-1-enyl]tetrahydropyran-2-yl]ethanethioic acid S-tert-butyl ester Formula: C21H30O3S MolecularWeight: 362.5261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC1CCC(C(O1)CC(=O)SC(C)(C)C)OCC2=CC=CC=C2

Isomeric SMILES

C/C=C/[C@H]1CC[C@@H]([C@H](O1)CC(=O)SC(C)(C)C)OCC2=CC=CC=C2

InChI

InChI=1S/C21H30O3S/c1-5-9-17-12-13-18(23-15-16-10-7-6-8-11-16)19(24-17)14-20(22)25-21(2,3)4/h5-11,17-19H,12-15H2,1-4H3/b9-5+/t17-,18-,19+/m0/s1