2,2-bis(fluoranyl)-3-(2-nitroimidazol-2-yl)-3-(propanoylamino)propanoic acid

Systemtic Name: 2,2-bis(fluoranyl)-3-(2-nitroimidazol-2-yl)-3-(propanoylamino)propanoic acid Openeye Name: 2,2-difluoro-3-(2-nitroimidazol-2-yl)-3-(propanoylamino)propanoic acid CAS Name: 2,2-difluoro-3-(2-nitro-2-imidazolyl)-3-(1-oxopropylamino)propanoic acid IUPAC Name: 2,2-difluoro-3-(2-nitroimidazol-2-yl)-3-(propanoylamino)propanoic acid Traditional Name: 2,2-difluoro-3-(2-nitroimidazol-2-yl)-3-propionamido-propionic acid Formula: C9H10F2N4O5 MolecularWeight: 292.196306

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(C1(N=CC=N1)[N+](=O)[O-])C(C(=O)O)(F)F

Isomeric SMILES

CCC(=O)NC(C1(N=CC=N1)[N+](=O)[O-])C(C(=O)O)(F)F

InChI

InChI=1S/C9H10F2N4O5/c1-2-5(16)14-6(8(10,11)7(17)18)9(15(19)20)12-3-4-13-9/h3-4,6H,2H2,1H3,(H,14,16)(H,17,18)