(1-oxidanyl-1-phosphono-2,2-dipyridin-3-yl-ethyl)phosphonic acid

Systemtic Name: (1-oxidanyl-1-phosphono-2,2-dipyridin-3-yl-ethyl)phosphonic acid Openeye Name: [1-hydroxy-1-phosphono-2,2-bis(3-pyridyl)ethyl]phosphonic acid CAS Name: [1-hydroxy-1-phosphono-2,2-bis(3-pyridinyl)ethyl]phosphonic acid IUPAC Name: (1-hydroxy-1-phosphono-2,2-dipyridin-3-ylethyl)phosphonic acid Traditional Name: [1-hydroxy-1-phosphono-2,2-bis(3-pyridyl)ethyl]phosphonic acid Formula: C12H14N2O7P2 MolecularWeight: 360.196282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(C2=CN=CC=C2)C(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CC(=CN=C1)C(C2=CN=CC=C2)C(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C12H14N2O7P2/c15-12(22(16,17)18,23(19,20)21)11(9-3-1-5-13-7-9)10-4-2-6-14-8-10/h1-8,11,15H,(H2,16,17,18)(H2,19,20,21)