[[2-azanylethoxy-[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]methoxy]-oxidanyl-phosphoryl] phosphono hydrogen phosphate

Systemtic Name: [[2-azanylethoxy-[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]methoxy]-oxidanyl-phosphoryl] phosphono hydrogen phosphate Openeye Name: [[2-aminoethoxy-[5-(4-amino-2-oxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy]-hydroxy-phosphoryl] phosphono hydrogen phosphate CAS Name: [[2-aminoethoxy-[5-(4-amino-2-oxo-1-pyrimidinyl)-3-hydroxy-2-oxolanyl]methoxy]-hydroxyphosphoryl] phosphono hydrogen phosphate IUPAC Name: [[2-aminoethoxy-[5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy]-hydroxyphosphoryl] phosphono hydrogen phosphate Traditional Name: [[2-aminoethoxy-[5-(4-amino-2-keto-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy]-hydroxy-phosphoryl] phosphono hydrogen phosphate Formula: C11H21N4O14P3 MolecularWeight: 526.224123

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=CC(=NC2=O)N)C(OCCN)OP(=O)(O)OP(=O)(O)OP(=O)(O)O)O

Isomeric SMILES

C1C(C(OC1N2C=CC(=NC2=O)N)C(OCCN)OP(=O)(O)OP(=O)(O)OP(=O)(O)O)O

InChI

InChI=1S/C11H21N4O14P3/c12-2-4-25-10(27-31(21,22)29-32(23,24)28-30(18,19)20)9-6(16)5-8(26-9)15-3-1-7(13)14-11(15)17/h1,3,6,8-10,16H,2,4-5,12H2,(H,21,22)(H,23,24)(H2,13,14,17)(H2,18,19,20)