(4-acetamidophenyl)methyl (2S,3S)-3-fluoranyl-2-oxidanyl-4-oxidanylidene-pentanoate

Systemtic Name: (4-acetamidophenyl)methyl (2S,3S)-3-fluoranyl-2-oxidanyl-4-oxidanylidene-pentanoate Openeye Name: (4-acetamidophenyl)methyl (2S,3S)-3-fluoro-2-hydroxy-4-oxo-pentanoate CAS Name: (2S,3S)-3-fluoro-2-hydroxy-4-oxopentanoic acid (4-acetamidophenyl)methyl ester IUPAC Name: (4-acetamidophenyl)methyl (2S,3S)-3-fluoro-2-hydroxy-4-oxopentanoate Traditional Name: (2S,3S)-3-fluoro-2-hydroxy-4-keto-valeric acid (4-acetamidobenzyl) ester Formula: C14H16FNO5 MolecularWeight: 297.278943

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(C(=O)OCC1=CC=C(C=C1)NC(=O)C)O)F

Isomeric SMILES

CC(=O)[C@H]([C@H](C(=O)OCC1=CC=C(C=C1)NC(=O)C)O)F

InChI

InChI=1S/C14H16FNO5/c1-8(17)12(15)13(19)14(20)21-7-10-3-5-11(6-4-10)16-9(2)18/h3-6,12-13,19H,7H2,1-2H3,(H,16,18)/t12-,13-/m1/s1