5-fluoranyl-2-methyl-2-oxidanyl-5,5-diphosphonato-pentanal

Systemtic Name: 5-fluoranyl-2-methyl-2-oxidanyl-5,5-diphosphonato-pentanal Openeye Name: 5-fluoro-2-hydroxy-2-methyl-5,5-diphosphonato-pentanal CAS Name: 5-fluoro-2-hydroxy-2-methyl-5,5-diphosphonatopentanal IUPAC Name: 5-fluoro-2-hydroxy-2-methyl-5,5-diphosphonatopentanal Traditional Name: 5-fluoro-2-hydroxy-2-methyl-5,5-diphosphonato-valeraldehyde Formula: C6H9FO8P2-4 MolecularWeight: 290.076785

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(F)(P(=O)([O-])[O-])P(=O)([O-])[O-])(C=O)O

Isomeric SMILES

CC(CCC(F)(P(=O)([O-])[O-])P(=O)([O-])[O-])(C=O)O

InChI

InChI=1S/C6H13FO8P2/c1-5(9,4-8)2-3-6(7,16(10,11)12)17(13,14)15/h4,9H,2-3H2,1H3,(H2,10,11,12)(H2,13,14,15)/p-4