[(2S,3S,5S)-3-(diethoxyphosphinothioylmethyl)-5-ethoxy-oxolan-2-yl]methyl benzoate

Systemtic Name: [(2S,3S,5S)-3-(diethoxyphosphinothioylmethyl)-5-ethoxy-oxolan-2-yl]methyl benzoate Openeye Name: [(2S,3S,5S)-3-(diethoxyphosphinothioylmethyl)-5-ethoxy-tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [(2S,3S,5S)-3-(diethoxyphosphinothioylmethyl)-5-ethoxy-2-oxolanyl]methyl ester IUPAC Name: [(2S,3S,5S)-3-(diethoxyphosphinothioylmethyl)-5-ethoxyoxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [(2S,3S,5S)-3-(diethoxythiophosphorylmethyl)-5-ethoxy-tetrahydrofuran-2-yl]methyl ester Formula: C19H29O6PS MolecularWeight: 416.468721

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1CC(C(O1)COC(=O)C2=CC=CC=C2)CP(=S)(OCC)OCC

Isomeric SMILES

CCO[C@@H]1C[C@@H]([C@H](O1)COC(=O)C2=CC=CC=C2)CP(=S)(OCC)OCC

InChI

InChI=1S/C19H29O6PS/c1-4-21-18-12-16(14-26(27,23-5-2)24-6-3)17(25-18)13-22-19(20)15-10-8-7-9-11-15/h7-11,16-18H,4-6,12-14H2,1-3H3/t16-,17-,18+/m1/s1