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

Systemtic Name: 2-[6-azanyl-2-(3-phenoxypropyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-2-(3-phenoxypropyl)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-2-(3-phenoxypropyl)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-2-(3-phenoxypropyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-2-(3-phenoxypropyl)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C19H23N5O5 MolecularWeight: 401.41642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O

Isomeric SMILES

C1=CC=C(C=C1)OCCCC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C19H23N5O5/c20-17-14-18(24(10-21-14)19-16(27)15(26)12(9-25)29-19)23-13(22-17)7-4-8-28-11-5-2-1-3-6-11/h1-3,5-6,10,12,15-16,19,25-27H,4,7-9H2,(H2,20,22,23)