(3-methyl-6-phosphono-4,5-dihydropyrimidin-6-yl)phosphonic acid

Systemtic Name: (3-methyl-6-phosphono-4,5-dihydropyrimidin-6-yl)phosphonic acid Openeye Name: (3-methyl-6-phosphono-4,5-dihydropyrimidin-6-yl)phosphonic acid CAS Name: (3-methyl-6-phosphono-4,5-dihydropyrimidin-6-yl)phosphonic acid IUPAC Name: (3-methyl-6-phosphono-4,5-dihydropyrimidin-6-yl)phosphonic acid Traditional Name: (3-methyl-6-phosphono-4,5-dihydropyrimidin-6-yl)phosphonic acid Formula: C5H12N2O6P2 MolecularWeight: 258.106102

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(N=C1)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CN1CCC(N=C1)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C5H12N2O6P2/c1-7-3-2-5(6-4-7,14(8,9)10)15(11,12)13/h4H,2-3H2,1H3,(H2,8,9,10)(H2,11,12,13)