3-[(6-aminopurin-9-yl)-iodanyl-methoxy]propyl (E)-oct-4-enoate

Systemtic Name: 3-[(6-aminopurin-9-yl)-iodanyl-methoxy]propyl (E)-oct-4-enoate Openeye Name: 3-[(6-aminopurin-9-yl)-iodo-methoxy]propyl (E)-oct-4-enoate CAS Name: (E)-4-octenoic acid 3-[(6-aminopurin-9-yl)-iodomethoxy]propyl ester IUPAC Name: 3-[(6-aminopurin-9-yl)-iodomethoxy]propyl (E)-oct-4-enoate Traditional Name: (E)-oct-4-enoic acid 3-[adenin-9-yl(iodo)methoxy]propyl ester Formula: C17H24IN5O3 MolecularWeight: 473.30863

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=CCCC(=O)OCCCOC(N1C=NC2=C1N=CN=C2N)I

Isomeric SMILES

CCC/C=C/CCC(=O)OCCCOC(N1C=NC2=C1N=CN=C2N)I

InChI

InChI=1S/C17H24IN5O3/c1-2-3-4-5-6-8-13(24)25-9-7-10-26-17(18)23-12-22-14-15(19)20-11-21-16(14)23/h4-5,11-12,17H,2-3,6-10H2,1H3,(H2,19,20,21)/b5-4+