[3,4-diacetyloxy-5-[6-(2,2-diphenylethylamino)-2-iodanyl-purin-9-yl]oxolan-2-yl]methyl ethanoate

Systemtic Name: [3,4-diacetyloxy-5-[6-(2,2-diphenylethylamino)-2-iodanyl-purin-9-yl]oxolan-2-yl]methyl ethanoate Openeye Name: [3,4-diacetoxy-5-[6-(2,2-diphenylethylamino)-2-iodo-purin-9-yl]tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [3,4-diacetyloxy-5-[6-(2,2-diphenylethylamino)-2-iodo-9-purinyl]-2-oxolanyl]methyl ester IUPAC Name: [3,4-diacetyloxy-5-[6-(2,2-diphenylethylamino)-2-iodopurin-9-yl]oxolan-2-yl]methyl acetate Traditional Name: acetic acid [3,4-diacetoxy-5-[6-(2,2-diphenylethylamino)-2-iodo-purin-9-yl]tetrahydrofuran-2-yl]methyl ester Formula: C30H30IN5O7 MolecularWeight: 699.49297

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(O1)N2C=NC3=C2N=C(N=C3NCC(C4=CC=CC=C4)C5=CC=CC=C5)I)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(O1)N2C=NC3=C2N=C(N=C3NCC(C4=CC=CC=C4)C5=CC=CC=C5)I)OC(=O)C)OC(=O)C

InChI

InChI=1S/C30H30IN5O7/c1-17(37)40-15-23-25(41-18(2)38)26(42-19(3)39)29(43-23)36-16-33-24-27(34-30(31)35-28(24)36)32-14-22(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-13,16,22-23,25-26,29H,14-15H2,1-3H3,(H,32,34,35)