[(1S,2R,3R)-3-(2-azanyl-6-iodanyl-purin-9-yl)-2-(hydroxymethyl)cyclobutyl]methanol

Systemtic Name: [(1S,2R,3R)-3-(2-azanyl-6-iodanyl-purin-9-yl)-2-(hydroxymethyl)cyclobutyl]methanol Openeye Name: [(1S,2R,3R)-3-(2-amino-6-iodo-purin-9-yl)-2-(hydroxymethyl)cyclobutyl]methanol CAS Name: [(1S,2R,3R)-3-(2-amino-6-iodo-9-purinyl)-2-(hydroxymethyl)cyclobutyl]methanol IUPAC Name: [(1S,2R,3R)-3-(2-amino-6-iodopurin-9-yl)-2-(hydroxymethyl)cyclobutyl]methanol Traditional Name: [(1S,2R,3R)-3-(2-amino-6-iodo-purin-9-yl)-2-methylol-cyclobutyl]methanol Formula: C11H14IN5O2 MolecularWeight: 375.16563

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C1N2C=NC3=C2N=C(N=C3I)N)CO)CO

Isomeric SMILES

C1[C@@H]([C@H]([C@@H]1N2C=NC3=C2N=C(N=C3I)N)CO)CO

InChI

InChI=1S/C11H14IN5O2/c12-9-8-10(16-11(13)15-9)17(4-14-8)7-1-5(2-18)6(7)3-19/h4-7,18-19H,1-3H2,(H2,13,15,16)/t5-,6-,7-/m1/s1