2-(4-azanyl-3-methyl-pyrrolo[2,3-d]pyrimidin-3-ium-7-yl)-5-(hydroxymethyl)oxolane-3,4-diol iodide

Systemtic Name: 2-(4-azanyl-3-methyl-pyrrolo[2,3-d]pyrimidin-3-ium-7-yl)-5-(hydroxymethyl)oxolane-3,4-diol iodide Openeye Name: 2-(4-amino-3-methyl-pyrrolo[2,3-d]pyrimidin-3-ium-7-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol iodide CAS Name: 2-(4-amino-3-methyl-7-pyrrolo[2,3-d]pyrimidin-3-iumyl)-5-(hydroxymethyl)oxolane-3,4-diol iodide IUPAC Name: 2-(4-amino-3-methylpyrrolo[2,3-d]pyrimidin-3-ium-7-yl)-5-(hydroxymethyl)oxolane-3,4-diol iodide Traditional Name: 2-(4-amino-3-methyl-pyrrolo[2,3-d]pyrimidin-3-ium-7-yl)-5-methylol-tetrahydrofuran-3,4-diol iodide Formula: C12H17IN4O4 MolecularWeight: 408.19225

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C2=C(N=C1)N(C=C2)C3C(C(C(O3)CO)O)O)N.[I-]

Isomeric SMILES

C[N+]1=C(C2=C(N=C1)N(C=C2)C3C(C(C(O3)CO)O)O)N.[I-]

InChI

InChI=1S/C12H16N4O4.HI/c1-15-5-14-11-6(10(15)13)2-3-16(11)12-9(19)8(18)7(4-17)20-12;/h2-3,5,7-9,12-13,17-19H,4H2,1H3;1H