[1-(6-aminopurin-9-yl)-3-morpholin-4-yl-propan-2-yl]oxymethylphosphonic acid

Systemtic Name: [1-(6-aminopurin-9-yl)-3-morpholin-4-yl-propan-2-yl]oxymethylphosphonic acid Openeye Name: [1-[(6-aminopurin-9-yl)methyl]-2-morpholino-ethoxy]methylphosphonic acid CAS Name: [1-(6-aminopurin-9-yl)-3-(4-morpholinyl)propan-2-yl]oxymethylphosphonic acid IUPAC Name: [1-(6-aminopurin-9-yl)-3-morpholin-4-ylpropan-2-yl]oxymethylphosphonic acid Traditional Name: [1-(adenin-9-ylmethyl)-2-morpholino-ethoxy]methylphosphonic acid Formula: C13H21N6O5P MolecularWeight: 372.316801

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC(CN2C=NC3=C2N=CN=C3N)OCP(=O)(O)O

Isomeric SMILES

C1COCCN1CC(CN2C=NC3=C2N=CN=C3N)OCP(=O)(O)O

InChI

InChI=1S/C13H21N6O5P/c14-12-11-13(16-7-15-12)19(8-17-11)6-10(24-9-25(20,21)22)5-18-1-3-23-4-2-18/h7-8,10H,1-6,9H2,(H2,14,15,16)(H2,20,21,22)