[2-[2-acetamido-6-[(4-iodophenyl)methoxy]purin-9-yl]-4,5-diacetyloxy-oxolan-3-yl] ethanoate

Systemtic Name: [2-[2-acetamido-6-[(4-iodophenyl)methoxy]purin-9-yl]-4,5-diacetyloxy-oxolan-3-yl] ethanoate Openeye Name: [2-[2-acetamido-6-[(4-iodophenyl)methoxy]purin-9-yl]-4,5-diacetoxy-tetrahydrofuran-3-yl] acetate CAS Name: acetic acid [2-[2-acetamido-6-[(4-iodophenyl)methoxy]-9-purinyl]-4,5-diacetyloxy-3-oxolanyl] ester IUPAC Name: [2-[2-acetamido-6-[(4-iodophenyl)methoxy]purin-9-yl]-4,5-diacetyloxyoxolan-3-yl] acetate Traditional Name: acetic acid [2-[2-acetamido-6-(4-iodobenzyl)oxy-purin-9-yl]-4,5-diacetoxy-tetrahydrofuran-3-yl] ester Formula: C24H24IN5O9 MolecularWeight: 653.37993

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(C(=N1)OCC3=CC=C(C=C3)I)N=CN2C4C(C(C(O4)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)NC1=NC2=C(C(=N1)OCC3=CC=C(C=C3)I)N=CN2C4C(C(C(O4)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C24H24IN5O9/c1-11(31)27-24-28-20-17(21(29-24)35-9-15-5-7-16(25)8-6-15)26-10-30(20)22-18(36-12(2)32)19(37-13(3)33)23(39-22)38-14(4)34/h5-8,10,18-19,22-23H,9H2,1-4H3,(H,27,28,29,31)