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

Systemtic Name: octyl (2S)-2-[[2,6-bis(fluoranyl)phenyl]carbonylamino]propanoate Openeye Name: octyl (2S)-2-[(2,6-difluorobenzoyl)amino]propanoate CAS Name: (2S)-2-[[(2,6-difluorophenyl)-oxomethyl]amino]propanoic acid octyl ester IUPAC Name: octyl (2S)-2-[(2,6-difluorobenzoyl)amino]propanoate Traditional Name: (2S)-2-[(2,6-difluorobenzoyl)amino]propionic acid octyl ester Formula: C18H25F2NO3 MolecularWeight: 341.392806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25F2NO3/c1-3-4-5-6-7-8-12-24-18(23)13(2)21-17(22)16-14(19)10-9-11-15(16)20/h9-11,13H,3-8,12H2,1-2H3,(H,21,22)/t13-/m0/s1