[5-(6-azanyl-7H-purin-2-yl)-3-(phenylcarbonyloxy)oxolan-2-yl]methyl benzoate

Systemtic Name: [5-(6-azanyl-7H-purin-2-yl)-3-(phenylcarbonyloxy)oxolan-2-yl]methyl benzoate Openeye Name: [5-(6-amino-7H-purin-2-yl)-3-benzoyloxy-tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [5-(6-amino-7H-purin-2-yl)-3-benzoyloxy-2-oxolanyl]methyl ester IUPAC Name: [5-(6-amino-7H-purin-2-yl)-3-benzoyloxyoxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [5-(6-amino-7H-purin-2-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(OC1C2=NC3=C(C(=N2)N)NC=N3)COC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

Isomeric SMILES

C1C(C(OC1C2=NC3=C(C(=N2)N)NC=N3)COC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H21N5O5/c25-20-19-22(27-13-26-19)29-21(28-20)17-11-16(34-24(31)15-9-5-2-6-10-15)18(33-17)12-32-23(30)14-7-3-1-4-8-14/h1-10,13,16-18H,11-12H2,(H3,25,26,27,28,29)