(1-methyl-6-phosphono-2,3-dihydropyridin-6-yl)phosphonic acid iodide

Systemtic Name: (1-methyl-6-phosphono-2,3-dihydropyridin-6-yl)phosphonic acid iodide Openeye Name: (1-methyl-6-phosphono-2,3-dihydropyridin-6-yl)phosphonic acid iodide CAS Name: (1-methyl-6-phosphono-2,3-dihydropyridin-6-yl)phosphonic acid iodide IUPAC Name: (1-methyl-6-phosphono-2,3-dihydropyridin-6-yl)phosphonic acid iodide Traditional Name: (1-methyl-6-phosphono-2,3-dihydropyridin-6-yl)phosphonic acid iodide Formula: C6H13INO6P2- MolecularWeight: 384.022512

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC=CC1(P(=O)(O)O)P(=O)(O)O.[I-]

Isomeric SMILES

CN1CCC=CC1(P(=O)(O)O)P(=O)(O)O.[I-]

InChI

InChI=1S/C6H13NO6P2.HI/c1-7-5-3-2-4-6(7,14(8,9)10)15(11,12)13;/h2,4H,3,5H2,1H3,(H2,8,9,10)(H2,11,12,13);1H/p-1