3-[[2,6-bis(azanyl)purin-9-yl]-iodanyl-methoxy]propyl 2,2-dimethylpropanoate

Systemtic Name: 3-[[2,6-bis(azanyl)purin-9-yl]-iodanyl-methoxy]propyl 2,2-dimethylpropanoate Openeye Name: 3-[(2,6-diaminopurin-9-yl)-iodo-methoxy]propyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid 3-[(2,6-diamino-9-purinyl)-iodomethoxy]propyl ester IUPAC Name: 3-[(2,6-diaminopurin-9-yl)-iodomethoxy]propyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid 3-[(2,6-diaminopurin-9-yl)-iodo-methoxy]propyl ester Formula: C14H21IN6O3 MolecularWeight: 448.25941

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCCCOC(N1C=NC2=C1N=C(N=C2N)N)I

Isomeric SMILES

CC(C)(C)C(=O)OCCCOC(N1C=NC2=C1N=C(N=C2N)N)I

InChI

InChI=1S/C14H21IN6O3/c1-14(2,3)11(22)23-5-4-6-24-12(15)21-7-18-8-9(16)19-13(17)20-10(8)21/h7,12H,4-6H2,1-3H3,(H4,16,17,19,20)