disodium 4-azanyl-1-[(2R,3R,4S)-3-oxidanyl-4-(phosphonatomethoxy)oxolan-2-yl]pyrimidin-2-one

Systemtic Name: disodium 4-azanyl-1-[(2R,3R,4S)-3-oxidanyl-4-(phosphonatomethoxy)oxolan-2-yl]pyrimidin-2-one Openeye Name: disodium 4-amino-1-[(2R,3R,4S)-3-hydroxy-4-(phosphonatomethoxy)tetrahydrofuran-2-yl]pyrimidin-2-one CAS Name: disodium 4-amino-1-[(2R,3R,4S)-3-hydroxy-4-(phosphonatomethoxy)-2-oxolanyl]-2-pyrimidinone IUPAC Name: disodium 4-amino-1-[(2R,3R,4S)-3-hydroxy-4-(phosphonatomethoxy)oxolan-2-yl]pyrimidin-2-one Traditional Name: disodium 4-amino-1-[(2R,3R,4S)-3-hydroxy-4-(phosphonatomethoxy)tetrahydrofuran-2-yl]pyrimidin-2-one Formula: C9H12N3Na2O7P MolecularWeight: 351.160781

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(O1)N2C=CC(=NC2=O)N)O)OCP(=O)([O-])[O-].[Na+].[Na+]

Isomeric SMILES

C1[C@@H]([C@H]([C@@H](O1)N2C=CC(=NC2=O)N)O)OCP(=O)([O-])[O-].[Na+].[Na+]

InChI

InChI=1S/C9H14N3O7P.2Na/c10-6-1-2-12(9(14)11-6)8-7(13)5(3-18-8)19-4-20(15,16)17;;/h1-2,5,7-8,13H,3-4H2,(H2,10,11,14)(H2,15,16,17);;/q;2*+1/p-2/t5-,7+,8+;;/m0../s1