7-(3-azanylpropyl)-1,3-dimethyl-8-morpholin-4-yl-purine-2,6-dione hydrochloride

Systemtic Name: 7-(3-azanylpropyl)-1,3-dimethyl-8-morpholin-4-yl-purine-2,6-dione hydrochloride Openeye Name: 7-(3-aminopropyl)-1,3-dimethyl-8-morpholino-purine-2,6-dione hydrochloride CAS Name: 7-(3-aminopropyl)-1,3-dimethyl-8-(4-morpholinyl)purine-2,6-dione hydrochloride IUPAC Name: 7-(3-aminopropyl)-1,3-dimethyl-8-morpholin-4-ylpurine-2,6-dione hydrochloride Traditional Name: 7-(3-aminopropyl)-1,3-dimethyl-8-morpholino-xanthine hydrochloride Formula: C14H23ClN6O3 MolecularWeight: 358.82382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCOCC3)CCCN.Cl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCOCC3)CCCN.Cl

InChI

InChI=1S/C14H22N6O3.ClH/c1-17-11-10(12(21)18(2)14(17)22)20(5-3-4-15)13(16-11)19-6-8-23-9-7-19;/h3-9,15H2,1-2H3;1H