(1-oxidanyl-1-phosphono-octan-2-yl)phosphonic acid

Systemtic Name: (1-oxidanyl-1-phosphono-octan-2-yl)phosphonic acid Openeye Name: 1-[hydroxy(phosphono)methyl]heptylphosphonic acid CAS Name: (1-hydroxy-1-phosphonooctan-2-yl)phosphonic acid IUPAC Name: (1-hydroxy-1-phosphonooctan-2-yl)phosphonic acid Traditional Name: 1-[hydroxy(phosphono)methyl]heptylphosphonic acid Formula: C8H20O7P2 MolecularWeight: 290.187722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(O)P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCCCCC(C(O)P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C8H20O7P2/c1-2-3-4-5-6-7(16(10,11)12)8(9)17(13,14)15/h7-9H,2-6H2,1H3,(H2,10,11,12)(H2,13,14,15)