[5-(6-aminopurin-9-yl)-3-(phenylcarbonyloxy)oxolan-2-yl]methyl benzoate

Systemtic Name: [5-(6-aminopurin-9-yl)-3-(phenylcarbonyloxy)oxolan-2-yl]methyl benzoate Openeye Name: [5-(6-aminopurin-9-yl)-3-benzoyloxy-tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [5-(6-aminopurin-9-yl)-3-benzoyloxy-2-oxolanyl]methyl ester IUPAC Name: [5-(6-aminopurin-9-yl)-3-benzoyloxyoxolan-2-yl]methyl benzoate Traditional Name: benzoic acid (5-adenin-9-yl-3-benzoyloxy-tetrahydrofuran-2-yl)methyl ester Formula: C24H21N5O5 MolecularWeight: 459.45404

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=CN=C3N)COC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

Isomeric SMILES

C1C(C(OC1N2C=NC3=C2N=CN=C3N)COC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H21N5O5/c25-21-20-22(27-13-26-21)29(14-28-20)19-11-17(34-24(31)16-9-5-2-6-10-16)18(33-19)12-32-23(30)15-7-3-1-4-8-15/h1-10,13-14,17-19H,11-12H2,(H2,25,26,27)