1,3-dimethyl-8-morpholin-4-yl-7-[(2R)-2-oxidanyl-3-prop-2-enoxy-propyl]purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-morpholin-4-yl-7-[(2R)-2-oxidanyl-3-prop-2-enoxy-propyl]purine-2,6-dione Openeye Name: 7-[(2R)-3-allyloxy-2-hydroxy-propyl]-1,3-dimethyl-8-morpholino-purine-2,6-dione CAS Name: 7-[(2R)-2-hydroxy-3-prop-2-enoxypropyl]-1,3-dimethyl-8-(4-morpholinyl)purine-2,6-dione IUPAC Name: 7-[(2R)-2-hydroxy-3-prop-2-enoxypropyl]-1,3-dimethyl-8-morpholin-4-ylpurine-2,6-dione Traditional Name: 7-[(2R)-3-allyloxy-2-hydroxy-propyl]-1,3-dimethyl-8-morpholino-xanthine Formula: C17H25N5O5 MolecularWeight: 379.4109

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCOCC3)CC(COCC=C)O

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCOCC3)C[C@H](COCC=C)O

InChI

InChI=1S/C17H25N5O5/c1-4-7-27-11-12(23)10-22-13-14(19(2)17(25)20(3)15(13)24)18-16(22)21-5-8-26-9-6-21/h4,12,23H,1,5-11H2,2-3H3/t12-/m1/s1