[5-(4-chloranyl-2,6-dimethoxy-pyrimidin-5-yl)-5-oxidanylidene-pentyl] bis(phenylmethyl) phosphate

Systemtic Name: [5-(4-chloranyl-2,6-dimethoxy-pyrimidin-5-yl)-5-oxidanylidene-pentyl] bis(phenylmethyl) phosphate Openeye Name: dibenzyl [5-(4-chloro-2,6-dimethoxy-pyrimidin-5-yl)-5-oxo-pentyl] phosphate CAS Name: phosphoric acid [5-(4-chloro-2,6-dimethoxy-5-pyrimidinyl)-5-oxopentyl] bis(phenylmethyl) ester IUPAC Name: dibenzyl [5-(4-chloro-2,6-dimethoxypyrimidin-5-yl)-5-oxopentyl] phosphate Traditional Name: phosphoric acid dibenzyl [5-(4-chloro-2,6-dimethoxy-pyrimidin-5-yl)-5-keto-pentyl] ester Formula: C25H28ClN2O7P MolecularWeight: 534.925781

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=NC(=N1)OC)Cl)C(=O)CCCCOP(=O)(OCC2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=NC(=N1)OC)Cl)C(=O)CCCCOP(=O)(OCC2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C25H28ClN2O7P/c1-31-24-22(23(26)27-25(28-24)32-2)21(29)15-9-10-16-33-36(30,34-17-19-11-5-3-6-12-19)35-18-20-13-7-4-8-14-20/h3-8,11-14H,9-10,15-18H2,1-2H3