N-[9-[(2R,3R,4R,5R)-3-[1-(2-fluorophenyl)-4-methoxy-piperidin-4-yl]oxy-4-oxidanyl-5-[(9-phenylxanthen-9-yl)oxymethyl]oxolan-2-yl]-6-oxidanylidene-3H-purin-2-yl]-2-phenyl-ethanamide

Systemtic Name: N-[9-[(2R,3R,4R,5R)-3-[1-(2-fluorophenyl)-4-methoxy-piperidin-4-yl]oxy-4-oxidanyl-5-[(9-phenylxanthen-9-yl)oxymethyl]oxolan-2-yl]-6-oxidanylidene-3H-purin-2-yl]-2-phenyl-ethanamide Openeye Name: N-[9-[(2R,3R,4R,5R)-3-[[1-(2-fluorophenyl)-4-methoxy-4-piperidyl]oxy]-4-hydroxy-5-[(9-phenylxanthen-9-yl)oxymethyl]tetrahydrofuran-2-yl]-6-oxo-3H-purin-2-yl]-2-phenyl-acetamide CAS Name: N-[9-[(2R,3R,4R,5R)-3-[[1-(2-fluorophenyl)-4-methoxy-4-piperidinyl]oxy]-4-hydroxy-5-[(9-phenyl-9-xanthenyl)oxymethyl]-2-oxolanyl]-6-oxo-3H-purin-2-yl]-2-phenylacetamide IUPAC Name: N-[9-[(2R,3R,4R,5R)-3-[1-(2-fluorophenyl)-4-methoxypiperidin-4-yl]oxy-4-hydroxy-5-[(9-phenylxanthen-9-yl)oxymethyl]oxolan-2-yl]-6-oxo-3H-purin-2-yl]-2-phenylacetamide Traditional Name: N-[9-[(2R,3R,4R,5R)-3-[[1-(2-fluorophenyl)-4-methoxy-4-piperidyl]oxy]-4-hydroxy-5-[(9-phenylxanthen-9-yl)oxymethyl]tetrahydrofuran-2-yl]-6-keto-3H-purin-2-yl]-2-phenyl-acetamide Formula: C49H45FN6O8 MolecularWeight: 864.915403

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CCN(CC1)C2=CC=CC=C2F)OC3C(C(OC3N4C=NC5=C4NC(=NC5=O)NC(=O)CC6=CC=CC=C6)COC7(C8=CC=CC=C8OC9=CC=CC=C97)C1=CC=CC=C1)O

Isomeric SMILES

COC1(CCN(CC1)C2=CC=CC=C2F)O[C@@H]3[C@@H]([C@H](O[C@H]3N4C=NC5=C4NC(=NC5=O)NC(=O)CC6=CC=CC=C6)COC7(C8=CC=CC=C8OC9=CC=CC=C97)C1=CC=CC=C1)O

InChI

InChI=1S/C49H45FN6O8/c1-60-48(24-26-55(27-25-48)36-21-11-10-20-35(36)50)64-43-42(58)39(29-61-49(32-16-6-3-7-17-32)33-18-8-12-22-37(33)62-38-23-13-9-19-34(38)49)63-46(43)56-30-51-41-44(56)53-47(54-45(41)59)52-40(57)28-31-14-4-2-5-15-31/h2-23,30,39,42-43,46,58H,24-29H2,1H3,(H2,52,53,54,57,59)/t39-,42-,43-,46-/m1/s1