ethyl 2-[(2S,3S)-4-oxidanyl-2,3-bis(phenylmethoxy)butyl]-1,3-dithiane-2-carboxylate

Systemtic Name: ethyl 2-[(2S,3S)-4-oxidanyl-2,3-bis(phenylmethoxy)butyl]-1,3-dithiane-2-carboxylate Openeye Name: ethyl 2-[(2S,3S)-2,3-dibenzyloxy-4-hydroxy-butyl]-1,3-dithiane-2-carboxylate CAS Name: 2-[(2S,3S)-4-hydroxy-2,3-bis(phenylmethoxy)butyl]-1,3-dithiane-2-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2S,3S)-4-hydroxy-2,3-bis(phenylmethoxy)butyl]-1,3-dithiane-2-carboxylate Traditional Name: 2-[(2S,3S)-2,3-dibenzoxy-4-hydroxy-butyl]-1,3-dithiane-2-carboxylic acid ethyl ester Formula: C25H32O5S2 MolecularWeight: 476.64858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(SCCCS1)CC(C(CO)OCC2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(SCCCS1)C[C@@H]([C@H](CO)OCC2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C25H32O5S2/c1-2-28-24(27)25(31-14-9-15-32-25)16-22(29-18-20-10-5-3-6-11-20)23(17-26)30-19-21-12-7-4-8-13-21/h3-8,10-13,22-23,26H,2,9,14-19H2,1H3/t22-,23-/m0/s1