(4S)-2,2-bis(fluoranyl)-5-methyl-3-oxidanyl-4-(phenylmethoxycarbonylamino)hexanoic acid

Systemtic Name: (4S)-2,2-bis(fluoranyl)-5-methyl-3-oxidanyl-4-(phenylmethoxycarbonylamino)hexanoic acid Openeye Name: (4S)-4-(benzyloxycarbonylamino)-2,2-difluoro-3-hydroxy-5-methyl-hexanoic acid CAS Name: (4S)-2,2-difluoro-3-hydroxy-5-methyl-4-(phenylmethoxycarbonylamino)hexanoic acid IUPAC Name: (4S)-2,2-difluoro-3-hydroxy-5-methyl-4-(phenylmethoxycarbonylamino)hexanoic acid Traditional Name: (4S)-4-(benzyloxycarbonylamino)-2,2-difluoro-3-hydroxy-5-methyl-hexanoic acid Formula: C15H19F2NO5 MolecularWeight: 331.311866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19F2NO5/c1-9(2)11(12(19)15(16,17)13(20)21)18-14(22)23-8-10-6-4-3-5-7-10/h3-7,9,11-12,19H,8H2,1-2H3,(H,18,22)(H,20,21)/t11-,12?/m0/s1