[(2S,4S,5R)-4-fluoranyl-5-purin-9-yl-oxolan-2-yl]methyl benzoate

Systemtic Name: [(2S,4S,5R)-4-fluoranyl-5-purin-9-yl-oxolan-2-yl]methyl benzoate Openeye Name: [(2S,4S,5R)-4-fluoro-5-purin-9-yl-tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [(2S,4S,5R)-4-fluoro-5-(9-purinyl)-2-oxolanyl]methyl ester IUPAC Name: [(2S,4S,5R)-4-fluoro-5-purin-9-yloxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [(2S,4S,5R)-4-fluoro-5-purin-9-yl-tetrahydrofuran-2-yl]methyl ester Formula: C17H15FN4O3 MolecularWeight: 342.324403

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(C1F)N2C=NC3=CN=CN=C32)COC(=O)C4=CC=CC=C4

Isomeric SMILES

C1[C@H](O[C@H]([C@H]1F)N2C=NC3=CN=CN=C32)COC(=O)C4=CC=CC=C4

InChI

InChI=1S/C17H15FN4O3/c18-13-6-12(8-24-17(23)11-4-2-1-3-5-11)25-16(13)22-10-21-14-7-19-9-20-15(14)22/h1-5,7,9-10,12-13,16H,6,8H2/t12-,13-,16+/m0/s1