[2-(3-methoxypyridin-2-yl)-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-(3-methoxypyridin-2-yl)-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-(3-methoxy-2-pyridyl)-1-phosphono-ethyl]phosphonic acid CAS Name: [2-(3-methoxy-2-pyridinyl)-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-(3-methoxypyridin-2-yl)-1-phosphonoethyl]phosphonic acid Traditional Name: [2-(3-methoxy-2-pyridyl)-1-phosphono-ethyl]phosphonic acid Formula: C8H13NO7P2 MolecularWeight: 297.138842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N=CC=C1)CC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

COC1=C(N=CC=C1)CC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C8H13NO7P2/c1-16-7-3-2-4-9-6(7)5-8(17(10,11)12)18(13,14)15/h2-4,8H,5H2,1H3,(H2,10,11,12)(H2,13,14,15)