[(2R,3R,4R,5R)-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-(1,3,2-oxathiaphospholan-2-yloxymethyl)-4-(phenylcarbonyloxy)oxolan-3-yl] benzoate

Systemtic Name: [(2R,3R,4R,5R)-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-(1,3,2-oxathiaphospholan-2-yloxymethyl)-4-(phenylcarbonyloxy)oxolan-3-yl] benzoate Openeye Name: [(2R,3R,4R,5R)-4-benzoyloxy-5-(2,4-dioxopyrimidin-1-yl)-2-(1,3,2-oxathiaphospholan-2-yloxymethyl)tetrahydrofuran-3-yl] benzoate CAS Name: benzoic acid [(2R,3R,4R,5R)-4-benzoyloxy-5-(2,4-dioxo-1-pyrimidinyl)-2-(1,3,2-oxathiaphospholan-2-yloxymethyl)-3-oxolanyl] ester IUPAC Name: [(2R,3R,4R,5R)-4-benzoyloxy-5-(2,4-dioxopyrimidin-1-yl)-2-(1,3,2-oxathiaphospholan-2-yloxymethyl)oxolan-3-yl] benzoate Traditional Name: benzoic acid [(2R,3R,4R,5R)-4-benzoyloxy-5-(2,4-diketopyrimidin-1-yl)-2-(1,3,2-oxathiaphospholan-2-yloxymethyl)tetrahydrofuran-3-yl] ester Formula: C25H23N2O9PS MolecularWeight: 558.496881

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Descriptors Computed from Structure

Canonical SMILES:

C1CSP(O1)OCC2C(C(C(O2)N3C=CC(=O)NC3=O)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

Isomeric SMILES

C1CSP(O1)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=CC(=O)NC3=O)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H23N2O9PS/c28-19-11-12-27(25(31)26-19)22-21(36-24(30)17-9-5-2-6-10-17)20(35-23(29)16-7-3-1-4-8-16)18(34-22)15-33-37-32-13-14-38-37/h1-12,18,20-22H,13-15H2,(H,26,28,31)/t18-,20-,21-,22-,37?/m1/s1