tert-butyl (2R,3R)-3-(phenylsulfanylmethyl)oxolane-2-carboxylate

Systemtic Name: tert-butyl (2R,3R)-3-(phenylsulfanylmethyl)oxolane-2-carboxylate Openeye Name: tert-butyl (2R,3R)-3-(phenylsulfanylmethyl)tetrahydrofuran-2-carboxylate CAS Name: (2R,3R)-3-[(phenylthio)methyl]-2-oxolanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,3R)-3-(phenylsulfanylmethyl)oxolane-2-carboxylate Traditional Name: (2R,3R)-3-[(phenylthio)methyl]tetrahydrofuran-2-carboxylic acid tert-butyl ester Formula: C16H22O3S MolecularWeight: 294.40908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1C(CCO1)CSC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)[C@H]1[C@@H](CCO1)CSC2=CC=CC=C2

InChI

InChI=1S/C16H22O3S/c1-16(2,3)19-15(17)14-12(9-10-18-14)11-20-13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3/t12-,14+/m0/s1