ethyl (2R,3S,4S,5R)-4-cyano-3-oxidanyl-3,5-diphenyl-thiolane-2-carboxylate

Systemtic Name: ethyl (2R,3S,4S,5R)-4-cyano-3-oxidanyl-3,5-diphenyl-thiolane-2-carboxylate Openeye Name: ethyl (2R,3S,4S,5R)-4-cyano-3-hydroxy-3,5-diphenyl-tetrahydrothiophene-2-carboxylate CAS Name: (2R,3S,4S,5R)-4-cyano-3-hydroxy-3,5-diphenyl-2-thiolanecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,3S,4S,5R)-4-cyano-3-hydroxy-3,5-diphenylthiolane-2-carboxylate Traditional Name: (2R,3S,4S,5R)-4-cyano-3-hydroxy-3,5-diphenyl-tetrahydrothiophene-2-carboxylic acid ethyl ester Formula: C20H19NO3S MolecularWeight: 353.43476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(C(S1)C2=CC=CC=C2)C#N)(C3=CC=CC=C3)O

Isomeric SMILES

CCOC(=O)[C@H]1[C@]([C@@H]([C@@H](S1)C2=CC=CC=C2)C#N)(C3=CC=CC=C3)O

InChI

InChI=1S/C20H19NO3S/c1-2-24-19(22)18-20(23,15-11-7-4-8-12-15)16(13-21)17(25-18)14-9-5-3-6-10-14/h3-12,16-18,23H,2H2,1H3/t16-,17+,18+,20-/m1/s1