tert-butyl (3S,4S)-2-oxidanylidene-4-(phenylsulfanylmethyl)oxolane-3-carboxylate

Systemtic Name: tert-butyl (3S,4S)-2-oxidanylidene-4-(phenylsulfanylmethyl)oxolane-3-carboxylate Openeye Name: tert-butyl (3S,4S)-2-oxo-4-(phenylsulfanylmethyl)tetrahydrofuran-3-carboxylate CAS Name: (3S,4S)-2-oxo-4-[(phenylthio)methyl]-3-oxolanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S,4S)-2-oxo-4-(phenylsulfanylmethyl)oxolane-3-carboxylate Traditional Name: (3S,4S)-2-keto-4-[(phenylthio)methyl]tetrahydrofuran-3-carboxylic acid tert-butyl ester Formula: C16H20O4S MolecularWeight: 308.3926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1C(COC1=O)CSC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)[C@H]1[C@@H](COC1=O)CSC2=CC=CC=C2

InChI

InChI=1S/C16H20O4S/c1-16(2,3)20-15(18)13-11(9-19-14(13)17)10-21-12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3/t11-,13-/m0/s1