1,3-dimethyl-7-[2-oxidanyl-3-(oxidanylamino)propyl]purine-2,6-dione hydrochloride

Systemtic Name: 1,3-dimethyl-7-[2-oxidanyl-3-(oxidanylamino)propyl]purine-2,6-dione hydrochloride Openeye Name: 7-[2-hydroxy-3-(hydroxyamino)propyl]-1,3-dimethyl-purine-2,6-dione hydrochloride CAS Name: 7-[2-hydroxy-3-(hydroxyamino)propyl]-1,3-dimethylpurine-2,6-dione hydrochloride IUPAC Name: 7-[2-hydroxy-3-(hydroxyamino)propyl]-1,3-dimethylpurine-2,6-dione hydrochloride Traditional Name: 7-[2-hydroxy-3-(hydroxyamino)propyl]-1,3-dimethyl-xanthine hydrochloride Formula: C10H16ClN5O4 MolecularWeight: 305.71814

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(CNO)O.Cl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(CNO)O.Cl

InChI

InChI=1S/C10H15N5O4.ClH/c1-13-8-7(9(17)14(2)10(13)18)15(5-11-8)4-6(16)3-12-19;/h5-6,12,16,19H,3-4H2,1-2H3;1H