[5-[5-bromanyl-2,4-bis(oxidanylidene)-1,3-diazinan-1-yl]-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate; sodium

Systemtic Name: [5-[5-bromanyl-2,4-bis(oxidanylidene)-1,3-diazinan-1-yl]-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate; sodium Openeye Name: [5-(5-bromo-2,4-dioxo-hexahydropyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate; sodium CAS Name: [5-(5-bromo-2,4-dioxo-1,3-diazinan-1-yl)-3-hydroxy-2-oxolanyl]methyl dihydrogen phosphate; sodium IUPAC Name: [5-(5-bromo-2,4-dioxo-1,3-diazinan-1-yl)-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate; sodium Traditional Name: [5-(5-bromo-2,4-diketo-hexahydropyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate; sodium Formula: C9H14BrN2NaO8P MolecularWeight: 412.083591

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2CC(C(=O)NC2=O)Br)COP(=O)(O)O)O.[Na]

Isomeric SMILES

C1C(C(OC1N2CC(C(=O)NC2=O)Br)COP(=O)(O)O)O.[Na]

InChI

InChI=1S/C9H14BrN2O8P.Na/c10-4-2-12(9(15)11-8(4)14)7-1-5(13)6(20-7)3-19-21(16,17)18;/h4-7,13H,1-3H2,(H,11,14,15)(H2,16,17,18);