[2-(2-imidazol-1-ylpropoxy)-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [2-(2-imidazol-1-ylpropoxy)-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [1-hydroxy-2-(2-imidazol-1-ylpropoxy)-1-phosphono-propyl]phosphonic acid CAS Name: [1-hydroxy-2-[2-(1-imidazolyl)propoxy]-1-phosphonopropyl]phosphonic acid IUPAC Name: [1-hydroxy-2-(2-imidazol-1-ylpropoxy)-1-phosphonopropyl]phosphonic acid Traditional Name: [1-hydroxy-2-(2-imidazol-1-ylpropoxy)-1-phosphono-propyl]phosphonic acid Formula: C9H18N2O8P2 MolecularWeight: 344.195342

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(C)C(O)(P(=O)(O)O)P(=O)(O)O)N1C=CN=C1

Isomeric SMILES

CC(COC(C)C(O)(P(=O)(O)O)P(=O)(O)O)N1C=CN=C1

InChI

InChI=1S/C9H18N2O8P2/c1-7(11-4-3-10-6-11)5-19-8(2)9(12,20(13,14)15)21(16,17)18/h3-4,6-8,12H,5H2,1-2H3,(H2,13,14,15)(H2,16,17,18)