[(2S)-1-[6-(hydroxymethyl)-2,3-dihydro-1,4-dithiin-5-yl]-3-phenylmethoxy-propan-2-yl] ethanoate

Systemtic Name: [(2S)-1-[6-(hydroxymethyl)-2,3-dihydro-1,4-dithiin-5-yl]-3-phenylmethoxy-propan-2-yl] ethanoate Openeye Name: [(1S)-1-(benzyloxymethyl)-2-[6-(hydroxymethyl)-2,3-dihydro-1,4-dithiin-5-yl]ethyl] acetate CAS Name: acetic acid [(2S)-1-[6-(hydroxymethyl)-2,3-dihydro-1,4-dithiin-5-yl]-3-phenylmethoxypropan-2-yl] ester IUPAC Name: [(2S)-1-[6-(hydroxymethyl)-2,3-dihydro-1,4-dithiin-5-yl]-3-phenylmethoxypropan-2-yl] acetate Traditional Name: acetic acid [(1S)-1-(benzoxymethyl)-2-(6-methylol-2,3-dihydro-1,4-dithiin-5-yl)ethyl] ester Formula: C17H22O4S2 MolecularWeight: 354.48418

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CC1=C(SCCS1)CO)COCC2=CC=CC=C2

Isomeric SMILES

CC(=O)O[C@@H](CC1=C(SCCS1)CO)COCC2=CC=CC=C2

InChI

InChI=1S/C17H22O4S2/c1-13(19)21-15(9-16-17(10-18)23-8-7-22-16)12-20-11-14-5-3-2-4-6-14/h2-6,15,18H,7-12H2,1H3/t15-/m0/s1