4,4,4-tris(fluoranyl)-3-oxidanyl-2-(phenylmethoxycarbonylamino)butanoic acid

Systemtic Name: 4,4,4-tris(fluoranyl)-3-oxidanyl-2-(phenylmethoxycarbonylamino)butanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-4,4,4-trifluoro-3-hydroxy-butanoic acid CAS Name: 4,4,4-trifluoro-3-hydroxy-2-(phenylmethoxycarbonylamino)butanoic acid IUPAC Name: 4,4,4-trifluoro-3-hydroxy-2-(phenylmethoxycarbonylamino)butanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-4,4,4-trifluoro-3-hydroxy-butyric acid Formula: C12H12F3NO5 MolecularWeight: 307.22259

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12F3NO5/c13-12(14,15)9(17)8(10(18)19)16-11(20)21-6-7-4-2-1-3-5-7/h1-5,8-9,17H,6H2,(H,16,20)(H,18,19)