(2S,3S,5R)-3-acetyloxy-5-[5-iodanyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolane-2-carboxylate

Systemtic Name: (2S,3S,5R)-3-acetyloxy-5-[5-iodanyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolane-2-carboxylate Openeye Name: (2S,3S,5R)-3-acetoxy-5-(5-iodo-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-carboxylate CAS Name: (2S,3S,5R)-3-acetyloxy-5-(5-iodo-2,4-dioxo-1-pyrimidinyl)-2-oxolanecarboxylate IUPAC Name: (2S,3S,5R)-3-acetyloxy-5-(5-iodo-2,4-dioxopyrimidin-1-yl)oxolane-2-carboxylate Traditional Name: (2S,3S,5R)-3-acetoxy-5-(5-iodo-2,4-diketo-pyrimidin-1-yl)tetrahydrofuran-2-carboxylate Formula: C11H10IN2O7- MolecularWeight: 409.11077

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(OC1C(=O)[O-])N2C=C(C(=O)NC2=O)I

Isomeric SMILES

CC(=O)O[C@H]1C[C@@H](O[C@@H]1C(=O)[O-])N2C=C(C(=O)NC2=O)I

InChI

InChI=1S/C11H11IN2O7/c1-4(15)20-6-2-7(21-8(6)10(17)18)14-3-5(12)9(16)13-11(14)19/h3,6-8H,2H2,1H3,(H,17,18)(H,13,16,19)/p-1/t6-,7+,8-/m0/s1