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

Systemtic Name: 2-[6-[(3,4-dimethoxyphenyl)amino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-(3,4-dimethoxyanilino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-(3,4-dimethoxyanilino)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-(3,4-dimethoxyanilino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-(3,4-dimethoxyanilino)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C18H21N5O6 MolecularWeight: 403.38924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)OC

InChI

InChI=1S/C18H21N5O6/c1-27-10-4-3-9(5-11(10)28-2)22-16-13-17(20-7-19-16)23(8-21-13)18-15(26)14(25)12(6-24)29-18/h3-5,7-8,12,14-15,18,24-26H,6H2,1-2H3,(H,19,20,22)