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

Systemtic Name: 2-[6-azanyl-2-[3-(3-methoxyphenyl)propoxy]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-2-[3-(3-methoxyphenyl)propoxy]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-2-[3-(3-methoxyphenyl)propoxy]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-2-[3-(3-methoxyphenyl)propoxy]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-2-[3-(3-methoxyphenyl)propoxy]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C20H25N5O6 MolecularWeight: 431.4424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CCCOC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O

Isomeric SMILES

COC1=CC=CC(=C1)CCCOC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C20H25N5O6/c1-29-12-6-2-4-11(8-12)5-3-7-30-20-23-17(21)14-18(24-20)25(10-22-14)19-16(28)15(27)13(9-26)31-19/h2,4,6,8,10,13,15-16,19,26-28H,3,5,7,9H2,1H3,(H2,21,23,24)