5-bromanyl-1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]pyrimidine-2,4-dione; phosphoric acid

Systemtic Name: 5-bromanyl-1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]pyrimidine-2,4-dione; phosphoric acid Openeye Name: 5-bromo-1-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione; phosphoric acid CAS Name: 5-bromo-1-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]pyrimidine-2,4-dione; phosphoric acid IUPAC Name: 5-bromo-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione; phosphoric acid Traditional Name: 5-bromo-1-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)pyrimidine-2,4-quinone; phosphoric acid Formula: C9H20BrN2O17P3 MolecularWeight: 601.083583

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=C(C(=O)NC2=O)Br)CO)O.OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O

Isomeric SMILES

C1C(C(OC1N2C=C(C(=O)NC2=O)Br)CO)O.OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O

InChI

InChI=1S/C9H11BrN2O5.3H3O4P/c10-4-2-12(9(16)11-8(4)15)7-1-5(14)6(3-13)17-7;3*1-5(2,3)4/h2,5-7,13-14H,1,3H2,(H,11,15,16);3*(H3,1,2,3,4)