5-[2-(2-azanylpurin-9-yl)ethyl]-1,3-dioxan-2-one

Systemtic Name: 5-[2-(2-azanylpurin-9-yl)ethyl]-1,3-dioxan-2-one Openeye Name: 5-[2-(2-aminopurin-9-yl)ethyl]-1,3-dioxan-2-one CAS Name: 5-[2-(2-amino-9-purinyl)ethyl]-1,3-dioxan-2-one IUPAC Name: 5-[2-(2-aminopurin-9-yl)ethyl]-1,3-dioxan-2-one Traditional Name: 5-[2-(2-aminopurin-9-yl)ethyl]-1,3-dioxan-2-one Formula: C11H13N5O3 MolecularWeight: 263.25262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(COC(=O)O1)CCN2C=NC3=CN=C(N=C32)N

Isomeric SMILES

C1C(COC(=O)O1)CCN2C=NC3=CN=C(N=C32)N

InChI

InChI=1S/C11H13N5O3/c12-10-13-3-8-9(15-10)16(6-14-8)2-1-7-4-18-11(17)19-5-7/h3,6-7H,1-2,4-5H2,(H2,12,13,15)