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

Systemtic Name: 7-[(2R)-3-chloranyl-2-oxidanyl-propyl]-1,3-dimethyl-8-morpholin-4-yl-purine-2,6-dione Openeye Name: 7-[(2R)-3-chloro-2-hydroxy-propyl]-1,3-dimethyl-8-morpholino-purine-2,6-dione CAS Name: 7-[(2R)-3-chloro-2-hydroxypropyl]-1,3-dimethyl-8-(4-morpholinyl)purine-2,6-dione IUPAC Name: 7-[(2R)-3-chloro-2-hydroxypropyl]-1,3-dimethyl-8-morpholin-4-ylpurine-2,6-dione Traditional Name: 7-[(2R)-3-chloro-2-hydroxy-propyl]-1,3-dimethyl-8-morpholino-xanthine Formula: C14H20ClN5O4 MolecularWeight: 357.7927

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20ClN5O4/c1-17-11-10(12(22)18(2)14(17)23)20(8-9(21)7-15)13(16-11)19-3-5-24-6-4-19/h9,21H,3-8H2,1-2H3/t9-/m0/s1