4,4-bis(fluoranyl)-2-(phenylmethoxycarbonylamino)butanoic acid

Systemtic Name: 4,4-bis(fluoranyl)-2-(phenylmethoxycarbonylamino)butanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-4,4-difluoro-butanoic acid CAS Name: 4,4-difluoro-2-(phenylmethoxycarbonylamino)butanoic acid IUPAC Name: 4,4-difluoro-2-(phenylmethoxycarbonylamino)butanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-4,4-difluoro-butyric acid Formula: C12H13F2NO4 MolecularWeight: 273.232726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13F2NO4/c13-10(14)6-9(11(16)17)15-12(18)19-7-8-4-2-1-3-5-8/h1-5,9-10H,6-7H2,(H,15,18)(H,16,17)