1-bromanyl-5-fluoranyl-2-methyl-5,5-diphosphonato-pentan-2-ol

Systemtic Name: 1-bromanyl-5-fluoranyl-2-methyl-5,5-diphosphonato-pentan-2-ol Openeye Name: 1-bromo-5-fluoro-2-methyl-5,5-diphosphonato-pentan-2-ol CAS Name: 1-bromo-5-fluoro-2-methyl-5,5-diphosphonato-2-pentanol IUPAC Name: 1-bromo-5-fluoro-2-methyl-5,5-diphosphonatopentan-2-ol Traditional Name: 1-bromo-5-fluoro-2-methyl-5,5-diphosphonato-pentan-2-ol Formula: C6H10BrFO7P2-4 MolecularWeight: 354.989325

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H14BrFO7P2/c1-5(9,4-7)2-3-6(8,16(10,11)12)17(13,14)15/h9H,2-4H2,1H3,(H2,10,11,12)(H2,13,14,15)/p-4