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

Systemtic Name: 2-(hydroxymethyl)-5-[6-(2,2,2-triphenylethylamino)purin-9-yl]oxolane-3,4-diol Openeye Name: 2-(hydroxymethyl)-5-[6-(2,2,2-triphenylethylamino)purin-9-yl]tetrahydrofuran-3,4-diol CAS Name: 2-(hydroxymethyl)-5-[6-(2,2,2-triphenylethylamino)-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-(hydroxymethyl)-5-[6-(2,2,2-triphenylethylamino)purin-9-yl]oxolane-3,4-diol Traditional Name: 2-methylol-5-[6-(2,2,2-triphenylethylamino)purin-9-yl]tetrahydrofuran-3,4-diol Formula: C30H29N5O4 MolecularWeight: 523.58236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C(CNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C30H29N5O4/c36-16-23-25(37)26(38)29(39-23)35-19-34-24-27(32-18-33-28(24)35)31-17-30(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-15,18-19,23,25-26,29,36-38H,16-17H2,(H,31,32,33)