N-[9-[5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-iodanyl-3-methoxy-oxolan-2-yl]purin-6-yl]benzamide

Systemtic Name: N-[9-[5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-iodanyl-3-methoxy-oxolan-2-yl]purin-6-yl]benzamide Openeye Name: N-[9-[5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-iodo-3-methoxy-tetrahydrofuran-2-yl]purin-6-yl]benzamide CAS Name: N-[9-[5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-iodo-3-methoxy-2-oxolanyl]-6-purinyl]benzamide IUPAC Name: N-[9-[5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-iodo-3-methoxyoxolan-2-yl]purin-6-yl]benzamide Traditional Name: N-[9-[5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-iodo-3-methoxy-tetrahydrofuran-2-yl]purin-6-yl]benzamide Formula: C39H36IN5O6 MolecularWeight: 797.63751

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(OC1N2C=NC3=C2N=CN=C3NC(=O)C4=CC=CC=C4)COC(C5=CC=CC=C5)(C6=CC=C(C=C6)OC)C7=CC=C(C=C7)OC)I

Isomeric SMILES

COC1C(C(OC1N2C=NC3=C2N=CN=C3NC(=O)C4=CC=CC=C4)COC(C5=CC=CC=C5)(C6=CC=C(C=C6)OC)C7=CC=C(C=C7)OC)I

InChI

InChI=1S/C39H36IN5O6/c1-47-29-18-14-27(15-19-29)39(26-12-8-5-9-13-26,28-16-20-30(48-2)21-17-28)50-22-31-32(40)34(49-3)38(51-31)45-24-43-33-35(41-23-42-36(33)45)44-37(46)25-10-6-4-7-11-25/h4-21,23-24,31-32,34,38H,22H2,1-3H3,(H,41,42,44,46)