hexyl (2S)-2-[[2,6-bis(fluoranyl)phenyl]carbonylamino]propanoate

Systemtic Name: hexyl (2S)-2-[[2,6-bis(fluoranyl)phenyl]carbonylamino]propanoate Openeye Name: hexyl (2S)-2-[(2,6-difluorobenzoyl)amino]propanoate CAS Name: (2S)-2-[[(2,6-difluorophenyl)-oxomethyl]amino]propanoic acid hexyl ester IUPAC Name: hexyl (2S)-2-[(2,6-difluorobenzoyl)amino]propanoate Traditional Name: (2S)-2-[(2,6-difluorobenzoyl)amino]propionic acid hexyl ester Formula: C16H21F2NO3 MolecularWeight: 313.339646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(C)NC(=O)C1=C(C=CC=C1F)F

Isomeric SMILES

CCCCCCOC(=O)[C@H](C)NC(=O)C1=C(C=CC=C1F)F

InChI

InChI=1S/C16H21F2NO3/c1-3-4-5-6-10-22-16(21)11(2)19-15(20)14-12(17)8-7-9-13(14)18/h7-9,11H,3-6,10H2,1-2H3,(H,19,20)/t11-/m0/s1