[5-(6-azanyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl)-4-oxidanyl-2-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate

Systemtic Name: [5-(6-azanyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl)-4-oxidanyl-2-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate Openeye Name: [5-(6-amino-2-oxo-1,6-dihydropyrimidin-3-yl)-4-hydroxy-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] dihydrogen phosphate CAS Name: [5-(6-amino-2-oxo-1,6-dihydropyrimidin-3-yl)-4-hydroxy-2-(phosphonooxymethyl)-3-oxolanyl] dihydrogen phosphate IUPAC Name: [5-(6-amino-2-oxo-1,6-dihydropyrimidin-3-yl)-4-hydroxy-2-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate Traditional Name: [5-(6-amino-2-keto-1,6-dihydropyrimidin-3-yl)-4-hydroxy-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] dihydrogen phosphate Formula: C9H17N3O11P2 MolecularWeight: 405.192302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)NC1N)C2C(C(C(O2)COP(=O)(O)O)OP(=O)(O)O)O

Isomeric SMILES

C1=CN(C(=O)NC1N)C2C(C(C(O2)COP(=O)(O)O)OP(=O)(O)O)O

InChI

InChI=1S/C9H17N3O11P2/c10-5-1-2-12(9(14)11-5)8-6(13)7(23-25(18,19)20)4(22-8)3-21-24(15,16)17/h1-2,4-8,13H,3,10H2,(H,11,14)(H2,15,16,17)(H2,18,19,20)