2-[6-(ethoxyamino)-2-iodanyl-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-(ethoxyamino)-2-iodanyl-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-(ethoxyamino)-2-iodo-purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-(ethoxyamino)-2-iodo-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-(ethoxyamino)-2-iodopurin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-(ethoxyamino)-2-iodo-purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C12H16IN5O5 MolecularWeight: 437.19041

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Descriptors Computed from Structure

Canonical SMILES:

CCONC1=NC(=NC2=C1N=CN2C3C(C(C(O3)CO)O)O)I

Isomeric SMILES

CCONC1=NC(=NC2=C1N=CN2C3C(C(C(O3)CO)O)O)I

InChI

InChI=1S/C12H16IN5O5/c1-2-22-17-9-6-10(16-12(13)15-9)18(4-14-6)11-8(21)7(20)5(3-19)23-11/h4-5,7-8,11,19-21H,2-3H2,1H3,(H,15,16,17)