2-[6-azanyl-2-(6-oxidanylhex-1-ynyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-azanyl-2-(6-oxidanylhex-1-ynyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-2-(6-hydroxyhex-1-ynyl)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-2-(6-hydroxyhex-1-ynyl)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-2-(6-hydroxyhex-1-ynyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-2-(6-hydroxyhex-1-ynyl)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C16H21N5O5 MolecularWeight: 363.36844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1C3C(C(C(O3)CO)O)O)N=C(N=C2N)C#CCCCCO

Isomeric SMILES

C1=NC2=C(N1C3C(C(C(O3)CO)O)O)N=C(N=C2N)C#CCCCCO

InChI

InChI=1S/C16H21N5O5/c17-14-11-15(20-10(19-14)5-3-1-2-4-6-22)21(8-18-11)16-13(25)12(24)9(7-23)26-16/h8-9,12-13,16,22-25H,1-2,4,6-7H2,(H2,17,19,20)