9-[3-(2-diethoxyphosphorylethyl)-4,5-dihydro-1,2-oxazol-5-yl]purin-6-amine

Systemtic Name: 9-[3-(2-diethoxyphosphorylethyl)-4,5-dihydro-1,2-oxazol-5-yl]purin-6-amine Openeye Name: 9-[3-(2-diethoxyphosphorylethyl)-4,5-dihydroisoxazol-5-yl]purin-6-amine CAS Name: 9-[3-(2-diethoxyphosphorylethyl)-4,5-dihydroisoxazol-5-yl]-6-purinamine IUPAC Name: 9-[3-(2-diethoxyphosphorylethyl)-4,5-dihydro-1,2-oxazol-5-yl]purin-6-amine Traditional Name: [9-[3-(2-diethoxyphosphorylethyl)-2-isoxazolin-5-yl]purin-6-yl]amine Formula: C14H21N6O4P MolecularWeight: 368.328101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CCC1=NOC(C1)N2C=NC3=C2N=CN=C3N)OCC

Isomeric SMILES

CCOP(=O)(CCC1=NOC(C1)N2C=NC3=C2N=CN=C3N)OCC

InChI

InChI=1S/C14H21N6O4P/c1-3-22-25(21,23-4-2)6-5-10-7-11(24-19-10)20-9-18-12-13(15)16-8-17-14(12)20/h8-9,11H,3-7H2,1-2H3,(H2,15,16,17)