[[1-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-propan-2-yl]oxy-[oxidanyl(oxidanylidene)phosphaniumyl]oxy-phosphonoperoxy-methyl]-oxidanyl-oxidanylidene-phosphanium

Systemtic Name: [[1-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-propan-2-yl]oxy-[oxidanyl(oxidanylidene)phosphaniumyl]oxy-phosphonoperoxy-methyl]-oxidanyl-oxidanylidene-phosphanium Openeye Name: [[1-[(4-amino-2-oxo-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]-[hydroxy(oxo)phosphaniumyl]oxy-phosphonoperoxy-methyl]-hydroxy-oxo-phosphonium CAS Name: [[1-(4-amino-2-oxo-1-pyrimidinyl)-3-hydroxypropan-2-yl]oxy-[hydroxy(oxo)phosphiniumyl]oxy-phosphonodioxymethyl]-hydroxy-oxophosphonium IUPAC Name: [[1-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxypropan-2-yl]oxy-[hydroxy(oxo)phosphaniumyl]oxy-phosphonoperoxymethyl]-hydroxy-oxophosphanium Traditional Name: [[1-[(4-amino-2-keto-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]-[hydroxy(keto)phosphiniumyl]oxy-phosphonoperoxy-methyl]-hydroxy-keto-phosphonium Formula: C8H14N3O13P3+2 MolecularWeight: 453.130343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)N=C1N)CC(CO)OC(OOP(=O)(O)O)(O[P+](=O)O)[P+](=O)O

Isomeric SMILES

C1=CN(C(=O)N=C1N)CC(CO)OC(OOP(=O)(O)O)(O[P+](=O)O)[P+](=O)O

InChI

InChI=1S/C8H11N3O13P3/c9-6-1-2-11(7(13)10-6)3-5(4-12)21-8(25(14)15,23-26(16)17)22-24-27(18,19)20/h1-2,5,12H,3-4H2,(H3-3,9,10,13,14,15,16,17,18,19,20)/q-1/p+3