6-chloranyl-8-(3-fluoranyl-4-methoxy-phenyl)-2-iodanyl-9-methyl-purine

Systemtic Name: 6-chloranyl-8-(3-fluoranyl-4-methoxy-phenyl)-2-iodanyl-9-methyl-purine Openeye Name: 6-chloro-8-(3-fluoro-4-methoxy-phenyl)-2-iodo-9-methyl-purine CAS Name: 6-chloro-8-(3-fluoro-4-methoxyphenyl)-2-iodo-9-methylpurine IUPAC Name: 6-chloro-8-(3-fluoro-4-methoxyphenyl)-2-iodo-9-methylpurine Traditional Name: 6-chloro-8-(3-fluoro-4-methoxy-phenyl)-2-iodo-9-methyl-purine Formula: C13H9ClFIN4O MolecularWeight: 418.592633

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC(=N2)I)Cl)N=C1C3=CC(=C(C=C3)OC)F

Isomeric SMILES

CN1C2=C(C(=NC(=N2)I)Cl)N=C1C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C13H9ClFIN4O/c1-20-11(6-3-4-8(21-2)7(15)5-6)17-9-10(14)18-13(16)19-12(9)20/h3-5H,1-2H3