S-ethyl (2R,3S,6S)-6-methoxy-2-[(E)-2-phenylethenyl]oxane-3-carbothioate

Systemtic Name: S-ethyl (2R,3S,6S)-6-methoxy-2-[(E)-2-phenylethenyl]oxane-3-carbothioate Openeye Name: S-ethyl (2R,3S,6S)-6-methoxy-2-[(E)-styryl]tetrahydropyran-3-carbothioate CAS Name: (2R,3S,6S)-6-methoxy-2-[(E)-2-phenylethenyl]-3-oxanecarbothioic acid S-ethyl ester IUPAC Name: S-ethyl (2R,3S,6S)-6-methoxy-2-[(E)-2-phenylethenyl]oxane-3-carbothioate Traditional Name: (2R,3S,6S)-6-methoxy-2-[(E)-styryl]tetrahydropyran-3-carbothioic acid S-ethyl ester Formula: C17H22O3S MolecularWeight: 306.41978

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C1CCC(OC1C=CC2=CC=CC=C2)OC

Isomeric SMILES

CCSC(=O)[C@H]1CC[C@H](O[C@@H]1/C=C/C2=CC=CC=C2)OC

InChI

InChI=1S/C17H22O3S/c1-3-21-17(18)14-10-12-16(19-2)20-15(14)11-9-13-7-5-4-6-8-13/h4-9,11,14-16H,3,10,12H2,1-2H3/b11-9+/t14-,15+,16-/m0/s1