[5-(6-methoxypurin-9-yl)-4-oxidanyl-3-propanoyloxy-oxolan-2-yl]methyl propanoate

Systemtic Name: [5-(6-methoxypurin-9-yl)-4-oxidanyl-3-propanoyloxy-oxolan-2-yl]methyl propanoate Openeye Name: [4-hydroxy-5-(6-methoxypurin-9-yl)-3-propanoyloxy-tetrahydrofuran-2-yl]methyl propanoate CAS Name: propanoic acid [4-hydroxy-5-(6-methoxy-9-purinyl)-3-(1-oxopropoxy)-2-oxolanyl]methyl ester IUPAC Name: [4-hydroxy-5-(6-methoxypurin-9-yl)-3-propanoyloxyoxolan-2-yl]methyl propanoate Traditional Name: propionic acid [4-hydroxy-5-(6-methoxypurin-9-yl)-3-propionyloxy-tetrahydrofuran-2-yl]methyl ester Formula: C17H22N4O7 MolecularWeight: 394.37918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3OC)O)OC(=O)CC

Isomeric SMILES

CCC(=O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3OC)O)OC(=O)CC

InChI

InChI=1S/C17H22N4O7/c1-4-10(22)26-6-9-14(28-11(23)5-2)13(24)17(27-9)21-8-20-12-15(21)18-7-19-16(12)25-3/h7-9,13-14,17,24H,4-6H2,1-3H3