3-[acetyloxy-[2-iodanyl-6-[[(4-methoxyphenyl)-diphenyl-methyl]amino]purin-9-yl]methoxy]propyl ethanoate

Systemtic Name: 3-[acetyloxy-[2-iodanyl-6-[[(4-methoxyphenyl)-diphenyl-methyl]amino]purin-9-yl]methoxy]propyl ethanoate Openeye Name: 3-[acetoxy-[2-iodo-6-[[(4-methoxyphenyl)-diphenyl-methyl]amino]purin-9-yl]methoxy]propyl acetate CAS Name: acetic acid 3-[acetyloxy-[2-iodo-6-[[(4-methoxyphenyl)-diphenylmethyl]amino]-9-purinyl]methoxy]propyl ester IUPAC Name: 3-[acetyloxy-[2-iodo-6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]methoxy]propyl acetate Traditional Name: acetic acid 3-[acetoxy-[2-iodo-6-[[(4-methoxyphenyl)-diphenyl-methyl]amino]purin-9-yl]methoxy]propyl ester Formula: C33H32IN5O6 MolecularWeight: 721.54155

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCOC(N1C=NC2=C1N=C(N=C2NC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=C(C=C5)OC)I)OC(=O)C

Isomeric SMILES

CC(=O)OCCCOC(N1C=NC2=C1N=C(N=C2NC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=C(C=C5)OC)I)OC(=O)C

InChI

InChI=1S/C33H32IN5O6/c1-22(40)43-19-10-20-44-32(45-23(2)41)39-21-35-28-29(36-31(34)37-30(28)39)38-33(24-11-6-4-7-12-24,25-13-8-5-9-14-25)26-15-17-27(42-3)18-16-26/h4-9,11-18,21,32H,10,19-20H2,1-3H3,(H,36,37,38)