2-[[2,6-bis(fluoranyl)phenyl]carbonylamino]pentanoic acid

Systemtic Name: 2-[[2,6-bis(fluoranyl)phenyl]carbonylamino]pentanoic acid Openeye Name: 2-[(2,6-difluorobenzoyl)amino]pentanoic acid CAS Name: 2-[[(2,6-difluorophenyl)-oxomethyl]amino]pentanoic acid IUPAC Name: 2-[(2,6-difluorobenzoyl)amino]pentanoic acid Traditional Name: 2-[(2,6-difluorobenzoyl)amino]valeric acid Formula: C12H13F2NO3 MolecularWeight: 257.233326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13F2NO3/c1-2-4-9(12(17)18)15-11(16)10-7(13)5-3-6-8(10)14/h3,5-6,9H,2,4H2,1H3,(H,15,16)(H,17,18)