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

Systemtic Name: [[4-(4-azanyl-5-methyl-2-oxidanylidene-pyrimidin-1-yl)-1,3-dioxolan-2-yl]methoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate Openeye Name: [[4-(4-amino-5-methyl-2-oxo-pyrimidin-1-yl)-1,3-dioxolan-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate CAS Name: [[4-(4-amino-5-methyl-2-oxo-1-pyrimidinyl)-1,3-dioxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate IUPAC Name: [[4-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-1,3-dioxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate Traditional Name: [[4-(4-amino-2-keto-5-methyl-pyrimidin-1-yl)-1,3-dioxolan-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate Formula: C9H16N3O13P3 MolecularWeight: 467.156923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)N=C1N)C2COC(O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O

Isomeric SMILES

CC1=CN(C(=O)N=C1N)C2COC(O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/C9H16N3O13P3/c1-5-2-12(9(13)11-8(5)10)6-3-21-7(23-6)4-22-27(17,18)25-28(19,20)24-26(14,15)16/h2,6-7H,3-4H2,1H3,(H,17,18)(H,19,20)(H2,10,11,13)(H2,14,15,16)