[(4-bromanyl-3-methyl-3-oxidanyl-butoxy)-oxidanyl-phosphoryl] phosphono hydrogen phosphate

Systemtic Name: [(4-bromanyl-3-methyl-3-oxidanyl-butoxy)-oxidanyl-phosphoryl] phosphono hydrogen phosphate Openeye Name: [(4-bromo-3-hydroxy-3-methyl-butoxy)-hydroxy-phosphoryl] phosphono hydrogen phosphate CAS Name: [(4-bromo-3-hydroxy-3-methylbutoxy)-hydroxyphosphoryl] phosphono hydrogen phosphate IUPAC Name: [(4-bromo-3-hydroxy-3-methylbutoxy)-hydroxyphosphoryl] phosphono hydrogen phosphate Traditional Name: [(4-bromo-3-hydroxy-3-methyl-butoxy)-hydroxy-phosphoryl] phosphono hydrogen phosphate Formula: C5H14BrO11P3 MolecularWeight: 422.983343

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOP(=O)(O)OP(=O)(O)OP(=O)(O)O)(CBr)O

Isomeric SMILES

CC(CCOP(=O)(O)OP(=O)(O)OP(=O)(O)O)(CBr)O

InChI

InChI=1S/C5H14BrO11P3/c1-5(7,4-6)2-3-15-19(11,12)17-20(13,14)16-18(8,9)10/h7H,2-4H2,1H3,(H,11,12)(H,13,14)(H2,8,9,10)