(6-azanyl-7H-purin-8-yl)methoxymethyl-(2,2-dimethylpropoxy)phosphinic acid

Systemtic Name: (6-azanyl-7H-purin-8-yl)methoxymethyl-(2,2-dimethylpropoxy)phosphinic acid Openeye Name: (6-amino-7H-purin-8-yl)methoxymethyl-(2,2-dimethylpropoxy)phosphinic acid CAS Name: (6-amino-7H-purin-8-yl)methoxymethyl-(2,2-dimethylpropoxy)phosphinic acid IUPAC Name: (6-amino-7H-purin-8-yl)methoxymethyl-(2,2-dimethylpropoxy)phosphinic acid Traditional Name: (6-amino-7H-purin-8-yl)methoxymethyl-neopentyloxy-phosphinic acid Formula: C12H20N5O4P MolecularWeight: 329.292061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COP(=O)(COCC1=NC2=C(N1)C(=NC=N2)N)O

Isomeric SMILES

CC(C)(C)COP(=O)(COCC1=NC2=C(N1)C(=NC=N2)N)O

InChI

InChI=1S/C12H20N5O4P/c1-12(2,3)5-21-22(18,19)7-20-4-8-16-9-10(13)14-6-15-11(9)17-8/h6H,4-5,7H2,1-3H3,(H,18,19)(H3,13,14,15,16,17)