(2S)-3,3,3-tris(fluoranyl)-2-methyl-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (2S)-3,3,3-tris(fluoranyl)-2-methyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (2S)-2-(benzyloxycarbonylamino)-3,3,3-trifluoro-2-methyl-propanoate CAS Name: (2S)-3,3,3-trifluoro-2-methyl-2-(phenylmethoxycarbonylamino)propanoate IUPAC Name: (2S)-3,3,3-trifluoro-2-methyl-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3,3,3-trifluoro-2-methyl-propionate Formula: C12H11F3NO4- MolecularWeight: 290.21525

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12F3NO4/c1-11(9(17)18,12(13,14)15)16-10(19)20-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,16,19)(H,17,18)/p-1/t11-/m0/s1