methyl (2S,4R)-5-cyano-6-(4-fluorophenyl)-2-oxidanyl-4-phenyl-3,4-dihydropyran-2-carboxylate

Systemtic Name: methyl (2S,4R)-5-cyano-6-(4-fluorophenyl)-2-oxidanyl-4-phenyl-3,4-dihydropyran-2-carboxylate Openeye Name: methyl (2S,4R)-5-cyano-6-(4-fluorophenyl)-2-hydroxy-4-phenyl-3,4-dihydropyran-2-carboxylate CAS Name: (2S,4R)-5-cyano-6-(4-fluorophenyl)-2-hydroxy-4-phenyl-3,4-dihydropyran-2-carboxylic acid methyl ester IUPAC Name: methyl (2S,4R)-5-cyano-6-(4-fluorophenyl)-2-hydroxy-4-phenyl-3,4-dihydropyran-2-carboxylate Traditional Name: (2S,4R)-5-cyano-6-(4-fluorophenyl)-2-hydroxy-4-phenyl-3,4-dihydropyran-2-carboxylic acid methyl ester Formula: C20H16FNO4 MolecularWeight: 353.343743

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC(C(=C(O1)C2=CC=C(C=C2)F)C#N)C3=CC=CC=C3)O

Isomeric SMILES

COC(=O)[C@@]1(C[C@@H](C(=C(O1)C2=CC=C(C=C2)F)C#N)C3=CC=CC=C3)O

InChI

InChI=1S/C20H16FNO4/c1-25-19(23)20(24)11-16(13-5-3-2-4-6-13)17(12-22)18(26-20)14-7-9-15(21)10-8-14/h2-10,16,24H,11H2,1H3/t16-,20+/m1/s1