2-[6-azanyl-2-[(3-iodanylphenyl)methyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-azanyl-2-[(3-iodanylphenyl)methyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-2-[(3-iodophenyl)methyl]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-2-[(3-iodophenyl)methyl]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-2-[(3-iodophenyl)methyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-2-(3-iodobenzyl)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C17H18IN5O4 MolecularWeight: 483.26039

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)CC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O

Isomeric SMILES

C1=CC(=CC(=C1)I)CC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C17H18IN5O4/c18-9-3-1-2-8(4-9)5-11-21-15(19)12-16(22-11)23(7-20-12)17-14(26)13(25)10(6-24)27-17/h1-4,7,10,13-14,17,24-26H,5-6H2,(H2,19,21,22)