(3,3-dimethyl-2-phosphono-1,3-diazinan-3-ium-1-yl)methylphosphonic acid

Systemtic Name: (3,3-dimethyl-2-phosphono-1,3-diazinan-3-ium-1-yl)methylphosphonic acid Openeye Name: (3,3-dimethyl-2-phosphono-hexahydropyrimidin-3-ium-1-yl)methylphosphonic acid CAS Name: (3,3-dimethyl-2-phosphono-1,3-diazinan-3-ium-1-yl)methylphosphonic acid IUPAC Name: (3,3-dimethyl-2-phosphono-1,3-diazinan-3-ium-1-yl)methylphosphonic acid Traditional Name: (3,3-dimethyl-2-phosphono-hexahydropyrimidin-3-ium-1-yl)methylphosphonic acid Formula: C7H19N2O6P2+ MolecularWeight: 289.183082

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCN(C1P(=O)(O)O)CP(=O)(O)O)C

Isomeric SMILES

C[N+]1(CCCN(C1P(=O)(O)O)CP(=O)(O)O)C

InChI

InChI=1S/C7H18N2O6P2/c1-9(2)5-3-4-8(6-16(10,11)12)7(9)17(13,14)15/h7H,3-6H2,1-2H3,(H3-,10,11,12,13,14,15)/p+1