[1-(diphosphonomethylamino)-3-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [1-(diphosphonomethylamino)-3-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [1-(diphosphonomethylamino)-3-hydroxy-1-phosphono-propyl]phosphonic acid CAS Name: [1-(diphosphonomethylamino)-3-hydroxy-1-phosphonopropyl]phosphonic acid IUPAC Name: [1-(diphosphonomethylamino)-3-hydroxy-1-phosphonopropyl]phosphonic acid Traditional Name: [1-(diphosphonomethylamino)-3-hydroxy-1-phosphono-propyl]phosphonic acid Formula: C4H15NO13P4 MolecularWeight: 409.055844

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Descriptors Computed from Structure

Canonical SMILES:

C(CO)C(NC(P(=O)(O)O)P(=O)(O)O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C(CO)C(NC(P(=O)(O)O)P(=O)(O)O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C4H15NO13P4/c6-2-1-4(21(13,14)15,22(16,17)18)5-3(19(7,8)9)20(10,11)12/h3,5-6H,1-2H2,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)