[[5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]-hexylperoxy-methyl] phosphono hydrogen phosphate

Systemtic Name: [[5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]-hexylperoxy-methyl] phosphono hydrogen phosphate Openeye Name: [[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]-hexylperoxy-methyl] phosphono hydrogen phosphate CAS Name: [[5-(2,4-dioxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]-hexyldioxymethyl] phosphono hydrogen phosphate IUPAC Name: [[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]-hexylperoxymethyl] phosphono hydrogen phosphate Traditional Name: [[5-(2,4-diketopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]-hexylperoxy-methyl] phosphono hydrogen phosphate Formula: C15H26N2O14P2 MolecularWeight: 520.319462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOOC(C1C(C(C(O1)N2C=CC(=O)NC2=O)O)O)OP(=O)(O)OP(=O)(O)O

Isomeric SMILES

CCCCCCOOC(C1C(C(C(O1)N2C=CC(=O)NC2=O)O)O)OP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/C15H26N2O14P2/c1-2-3-4-5-8-27-29-14(30-33(25,26)31-32(22,23)24)12-10(19)11(20)13(28-12)17-7-6-9(18)16-15(17)21/h6-7,10-14,19-20H,2-5,8H2,1H3,(H,25,26)(H,16,18,21)(H2,22,23,24)