3,4,5-triacetyloxy-6-(5-fluoranyl-2-phenylmethoxy-pyrimidin-4-yl)oxy-oxane-2-carboxylic acid

Systemtic Name: 3,4,5-triacetyloxy-6-(5-fluoranyl-2-phenylmethoxy-pyrimidin-4-yl)oxy-oxane-2-carboxylic acid Openeye Name: 3,4,5-triacetoxy-6-(2-benzyloxy-5-fluoro-pyrimidin-4-yl)oxy-tetrahydropyran-2-carboxylic acid CAS Name: 3,4,5-triacetyloxy-6-[(5-fluoro-2-phenylmethoxy-4-pyrimidinyl)oxy]-2-oxanecarboxylic acid IUPAC Name: 3,4,5-triacetyloxy-6-(5-fluoro-2-phenylmethoxypyrimidin-4-yl)oxyoxane-2-carboxylic acid Traditional Name: 3,4,5-triacetoxy-6-(2-benzoxy-5-fluoro-pyrimidin-4-yl)oxy-tetrahydropyran-2-carboxylic acid Formula: C23H23FN2O11 MolecularWeight: 522.433923

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(OC(C1OC(=O)C)OC2=NC(=NC=C2F)OCC3=CC=CC=C3)C(=O)O)OC(=O)C

Isomeric SMILES

CC(=O)OC1C(C(OC(C1OC(=O)C)OC2=NC(=NC=C2F)OCC3=CC=CC=C3)C(=O)O)OC(=O)C

InChI

InChI=1S/C23H23FN2O11/c1-11(27)33-16-17(34-12(2)28)19(35-13(3)29)22(36-18(16)21(30)31)37-20-15(24)9-25-23(26-20)32-10-14-7-5-4-6-8-14/h4-9,16-19,22H,10H2,1-3H3,(H,30,31)