[2,7-bis(oxidanyl)-7-phosphono-octan-2-yl]phosphonic acid

Systemtic Name: [2,7-bis(oxidanyl)-7-phosphono-octan-2-yl]phosphonic acid Openeye Name: (1,6-dihydroxy-1-methyl-6-phosphono-heptyl)phosphonic acid CAS Name: (2,7-dihydroxy-7-phosphonooctan-2-yl)phosphonic acid IUPAC Name: (2,7-dihydroxy-7-phosphonooctan-2-yl)phosphonic acid Traditional Name: (1,6-dihydroxy-1-methyl-6-phosphono-heptyl)phosphonic acid Formula: C8H20O8P2 MolecularWeight: 306.187122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCC(C)(O)P(=O)(O)O)(O)P(=O)(O)O

Isomeric SMILES

CC(CCCCC(C)(O)P(=O)(O)O)(O)P(=O)(O)O

InChI

InChI=1S/C8H20O8P2/c1-7(9,17(11,12)13)5-3-4-6-8(2,10)18(14,15)16/h9-10H,3-6H2,1-2H3,(H2,11,12,13)(H2,14,15,16)