[(3R,4R,5S)-2-acetyloxy-4-phenylmethoxy-5-(phenylmethoxymethyl)thiolan-3-yl] benzoate

Systemtic Name: [(3R,4R,5S)-2-acetyloxy-4-phenylmethoxy-5-(phenylmethoxymethyl)thiolan-3-yl] benzoate Openeye Name: [(3R,4R,5S)-2-acetoxy-4-benzyloxy-5-(benzyloxymethyl)tetrahydrothiophen-3-yl] benzoate CAS Name: benzoic acid [(3R,4R,5S)-2-acetyloxy-4-phenylmethoxy-5-(phenylmethoxymethyl)-3-thiolanyl] ester IUPAC Name: [(3R,4R,5S)-2-acetyloxy-4-phenylmethoxy-5-(phenylmethoxymethyl)thiolan-3-yl] benzoate Traditional Name: benzoic acid [(3R,4R,5S)-2-acetoxy-4-benzoxy-5-(benzoxymethyl)tetrahydrothiophen-3-yl] ester Formula: C28H28O6S MolecularWeight: 492.58332

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(C(S1)COCC2=CC=CC=C2)OCC3=CC=CC=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)OC1[C@@H]([C@H]([C@@H](S1)COCC2=CC=CC=C2)OCC3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H28O6S/c1-20(29)33-28-26(34-27(30)23-15-9-4-10-16-23)25(32-18-22-13-7-3-8-14-22)24(35-28)19-31-17-21-11-5-2-6-12-21/h2-16,24-26,28H,17-19H2,1H3/t24-,25-,26+,28?/m0/s1