[(2R)-1-[6-(butoxycarbonylamino)purin-9-yl]propan-2-yl]oxymethylphosphonic acid

Systemtic Name: [(2R)-1-[6-(butoxycarbonylamino)purin-9-yl]propan-2-yl]oxymethylphosphonic acid Openeye Name: [(1R)-2-[6-(butoxycarbonylamino)purin-9-yl]-1-methyl-ethoxy]methylphosphonic acid CAS Name: [(2R)-1-[6-[[butoxy(oxo)methyl]amino]-9-purinyl]propan-2-yl]oxymethylphosphonic acid IUPAC Name: [(2R)-1-[6-(butoxycarbonylamino)purin-9-yl]propan-2-yl]oxymethylphosphonic acid Traditional Name: [(1R)-2-[6-(butoxycarbonylamino)purin-9-yl]-1-methyl-ethoxy]methylphosphonic acid Formula: C14H22N5O6P MolecularWeight: 387.328141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC1=NC=NC2=C1N=CN2CC(C)OCP(=O)(O)O

Isomeric SMILES

CCCCOC(=O)NC1=NC=NC2=C1N=CN2C[C@@H](C)OCP(=O)(O)O

InChI

InChI=1S/C14H22N5O6P/c1-3-4-5-24-14(20)18-12-11-13(16-7-15-12)19(8-17-11)6-10(2)25-9-26(21,22)23/h7-8,10H,3-6,9H2,1-2H3,(H2,21,22,23)(H,15,16,18,20)/t10-/m1/s1