4-azanyl-1-[6-(hydroxymethyl)-2-oxidanyl-2-oxidanylidene-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]pyrimidin-2-one; barium(2+); hydride

Systemtic Name: 4-azanyl-1-[6-(hydroxymethyl)-2-oxidanyl-2-oxidanylidene-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]pyrimidin-2-one; barium(2+); hydride Openeye Name: 4-amino-1-[2-hydroxy-6-(hydroxymethyl)-2-oxo-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]pyrimidin-2-one; barium(2+); hydride CAS Name: 4-amino-1-[2-hydroxy-6-(hydroxymethyl)-2-oxo-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]-2-pyrimidinone; barium(2+); hydride IUPAC Name: 4-amino-1-[2-hydroxy-6-(hydroxymethyl)-2-oxo-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]pyrimidin-2-one; barium(2+); hydride Traditional Name: 4-amino-1-(2-hydroxy-2-keto-6-methylol-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl)pyrimidin-2-one; barium(2+); hydride Formula: C9H14BaN3O7P MolecularWeight: 444.524121

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Descriptors Computed from Structure

Canonical SMILES:

[H-].[H-].C1=CN(C(=O)N=C1N)C2C3C(C(O2)CO)OP(=O)(O3)O.[Ba+2]

Isomeric SMILES

[H-].[H-].C1=CN(C(=O)N=C1N)C2C3C(C(O2)CO)OP(=O)(O3)O.[Ba+2]

InChI

InChI=1S/C9H12N3O7P.Ba.2H/c10-5-1-2-12(9(14)11-5)8-7-6(4(3-13)17-8)18-20(15,16)19-7;;;/h1-2,4,6-8,13H,3H2,(H,15,16)(H2,10,11,14);;;/q;+2;2*-1