5,5-bis(fluoranyl)-4-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: 5,5-bis(fluoranyl)-4-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: 4-(benzyloxycarbonylamino)-5,5-difluoro-pentanoic acid CAS Name: 5,5-difluoro-4-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: 5,5-difluoro-4-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: 4-(benzyloxycarbonylamino)-5,5-difluoro-valeric acid Formula: C13H15F2NO4 MolecularWeight: 287.259306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15F2NO4/c14-12(15)10(6-7-11(17)18)16-13(19)20-8-9-4-2-1-3-5-9/h1-5,10,12H,6-8H2,(H,16,19)(H,17,18)