(1-phosphono-3-pyridin-2-yl-propyl)phosphonic acid

Systemtic Name: (1-phosphono-3-pyridin-2-yl-propyl)phosphonic acid Openeye Name: [1-phosphono-3-(2-pyridyl)propyl]phosphonic acid CAS Name: [1-phosphono-3-(2-pyridinyl)propyl]phosphonic acid IUPAC Name: (1-phosphono-3-pyridin-2-ylpropyl)phosphonic acid Traditional Name: [1-phosphono-3-(2-pyridyl)propyl]phosphonic acid Formula: C8H13NO6P2 MolecularWeight: 281.139442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CC=NC(=C1)CCC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C8H13NO6P2/c10-16(11,12)8(17(13,14)15)5-4-7-3-1-2-6-9-7/h1-3,6,8H,4-5H2,(H2,10,11,12)(H2,13,14,15)