(2-phosphono-1-pyridin-2-yl-propan-2-yl)phosphonic acid

Systemtic Name: (2-phosphono-1-pyridin-2-yl-propan-2-yl)phosphonic acid Openeye Name: [1-methyl-1-phosphono-2-(2-pyridyl)ethyl]phosphonic acid CAS Name: [2-phosphono-1-(2-pyridinyl)propan-2-yl]phosphonic acid IUPAC Name: (2-phosphono-1-pyridin-2-ylpropan-2-yl)phosphonic acid Traditional Name: [1-methyl-1-phosphono-2-(2-pyridyl)ethyl]phosphonic acid Formula: C8H13NO6P2 MolecularWeight: 281.139442

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=N1)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC(CC1=CC=CC=N1)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C8H13NO6P2/c1-8(16(10,11)12,17(13,14)15)6-7-4-2-3-5-9-7/h2-5H,6H2,1H3,(H2,10,11,12)(H2,13,14,15)