1,4-diphosphonobutylphosphonic acid

Systemtic Name: 1,4-diphosphonobutylphosphonic acid Openeye Name: 1,4-diphosphonobutylphosphonic acid CAS Name: 1,4-diphosphonobutylphosphonic acid IUPAC Name: 1,4-diphosphonobutylphosphonic acid Traditional Name: 1,4-diphosphonobutylphosphonic acid Formula: C4H13O9P3 MolecularWeight: 298.061903

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(P(=O)(O)O)P(=O)(O)O)CP(=O)(O)O

Isomeric SMILES

C(CC(P(=O)(O)O)P(=O)(O)O)CP(=O)(O)O

InChI

InChI=1S/C4H13O9P3/c5-14(6,7)3-1-2-4(15(8,9)10)16(11,12)13/h4H,1-3H2,(H2,5,6,7)(H2,8,9,10)(H2,11,12,13)