methyl 5-[(2R,4S,5E)-2-methoxy-5-(2-phenylsulfanylethylidene)oxan-4-yl]-3-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[(2R,4S,5E)-2-methoxy-5-(2-phenylsulfanylethylidene)oxan-4-yl]-3-oxidanylidene-pentanoate Openeye Name: methyl 5-[(2R,4S,5E)-2-methoxy-5-(2-phenylsulfanylethylidene)tetrahydropyran-4-yl]-3-oxo-pentanoate CAS Name: 5-[(2R,4S,5E)-2-methoxy-5-[2-(phenylthio)ethylidene]-4-oxanyl]-3-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[(2R,4S,5E)-2-methoxy-5-(2-phenylsulfanylethylidene)oxan-4-yl]-3-oxopentanoate Traditional Name: 3-keto-5-[(2R,4S,5E)-2-methoxy-5-[2-(phenylthio)ethylidene]tetrahydropyran-4-yl]valeric acid methyl ester Formula: C20H26O5S MolecularWeight: 378.48244

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(C(=CCSC2=CC=CC=C2)CO1)CCC(=O)CC(=O)OC

Isomeric SMILES

CO[C@H]1C[C@@H](/C(=C\CSC2=CC=CC=C2)/CO1)CCC(=O)CC(=O)OC

InChI

InChI=1S/C20H26O5S/c1-23-19(22)13-17(21)9-8-15-12-20(24-2)25-14-16(15)10-11-26-18-6-4-3-5-7-18/h3-7,10,15,20H,8-9,11-14H2,1-2H3/b16-10-/t15-,20+/m0/s1