1,3-dimethyl-7-(3-morpholin-4-yl-3-oxidanylidene-propyl)purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-(3-morpholin-4-yl-3-oxidanylidene-propyl)purine-2,6-dione Openeye Name: 1,3-dimethyl-7-(3-morpholino-3-oxo-propyl)purine-2,6-dione CAS Name: 1,3-dimethyl-7-[3-(4-morpholinyl)-3-oxopropyl]purine-2,6-dione IUPAC Name: 1,3-dimethyl-7-(3-morpholin-4-yl-3-oxopropyl)purine-2,6-dione Traditional Name: 7-(3-keto-3-morpholino-propyl)-1,3-dimethyl-xanthine Formula: C14H19N5O4 MolecularWeight: 321.33176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)N3CCOCC3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)N3CCOCC3

InChI

InChI=1S/C14H19N5O4/c1-16-12-11(13(21)17(2)14(16)22)19(9-15-12)4-3-10(20)18-5-7-23-8-6-18/h9H,3-8H2,1-2H3