methyl 2-[(2R,3R,4S)-5-oxidanylidene-4-phenylsulfanyl-2-propyl-oxolan-3-yl]ethanoate

Systemtic Name: methyl 2-[(2R,3R,4S)-5-oxidanylidene-4-phenylsulfanyl-2-propyl-oxolan-3-yl]ethanoate Openeye Name: methyl 2-[(2R,3R,4S)-5-oxo-4-phenylsulfanyl-2-propyl-tetrahydrofuran-3-yl]acetate CAS Name: 2-[(2R,3R,4S)-5-oxo-4-(phenylthio)-2-propyl-3-oxolanyl]acetic acid methyl ester IUPAC Name: methyl 2-[(2R,3R,4S)-5-oxo-4-phenylsulfanyl-2-propyloxolan-3-yl]acetate Traditional Name: 2-[(2R,3R,4S)-5-keto-4-(phenylthio)-2-propyl-tetrahydrofuran-3-yl]acetic acid methyl ester Formula: C16H20O4S MolecularWeight: 308.3926

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C(C(=O)O1)SC2=CC=CC=C2)CC(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C16H20O4S/c1-3-7-13-12(10-14(17)19-2)15(16(18)20-13)21-11-8-5-4-6-9-11/h4-6,8-9,12-13,15H,3,7,10H2,1-2H3/t12-,13-,15+/m1/s1