3-[(2-azanylpurin-9-yl)-iodanyl-methoxy]propyl 2,2-dimethylpropanoate

Systemtic Name: 3-[(2-azanylpurin-9-yl)-iodanyl-methoxy]propyl 2,2-dimethylpropanoate Openeye Name: 3-[(2-aminopurin-9-yl)-iodo-methoxy]propyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid 3-[(2-amino-9-purinyl)-iodomethoxy]propyl ester IUPAC Name: 3-[(2-aminopurin-9-yl)-iodomethoxy]propyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid 3-[(2-aminopurin-9-yl)-iodo-methoxy]propyl ester Formula: C14H20IN5O3 MolecularWeight: 433.24477

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCCCOC(N1C=NC2=CN=C(N=C21)N)I

Isomeric SMILES

CC(C)(C)C(=O)OCCCOC(N1C=NC2=CN=C(N=C21)N)I

InChI

InChI=1S/C14H20IN5O3/c1-14(2,3)11(21)22-5-4-6-23-12(15)20-8-18-9-7-17-13(16)19-10(9)20/h7-8,12H,4-6H2,1-3H3,(H2,16,17,19)