(2S)-5-ethoxy-4,4-bis(fluoranyl)-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: (2S)-5-ethoxy-4,4-bis(fluoranyl)-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: (2S)-2-(benzyloxycarbonylamino)-5-ethoxy-4,4-difluoro-5-oxo-pentanoic acid CAS Name: (2S)-5-ethoxy-4,4-difluoro-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: (2S)-5-ethoxy-4,4-difluoro-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: (2S)-2-(benzyloxycarbonylamino)-5-ethoxy-4,4-difluoro-5-keto-valeric acid Formula: C15H17F2NO6 MolecularWeight: 345.295386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17F2NO6/c1-2-23-13(21)15(16,17)8-11(12(19)20)18-14(22)24-9-10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3,(H,18,22)(H,19,20)/t11-/m0/s1