(1-oxidanyl-1-phosphono-3-pyridin-3-yl-propyl)phosphonic acid; sodium

Systemtic Name: (1-oxidanyl-1-phosphono-3-pyridin-3-yl-propyl)phosphonic acid; sodium Openeye Name: [1-hydroxy-1-phosphono-3-(3-pyridyl)propyl]phosphonic acid; sodium CAS Name: [1-hydroxy-1-phosphono-3-(3-pyridinyl)propyl]phosphonic acid; sodium IUPAC Name: (1-hydroxy-1-phosphono-3-pyridin-3-ylpropyl)phosphonic acid; sodium Traditional Name: [1-hydroxy-1-phosphono-3-(3-pyridyl)propyl]phosphonic acid; sodium Formula: C8H13NNaO7P2 MolecularWeight: 320.128612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCC(O)(P(=O)(O)O)P(=O)(O)O.[Na]

Isomeric SMILES

C1=CC(=CN=C1)CCC(O)(P(=O)(O)O)P(=O)(O)O.[Na]

InChI

InChI=1S/C8H13NO7P2.Na/c10-8(17(11,12)13,18(14,15)16)4-3-7-2-1-5-9-6-7;/h1-2,5-6,10H,3-4H2,(H2,11,12,13)(H2,14,15,16);