8-(diethylaminomethyl)-3,7-dimethyl-purine-2,6-dione hydrochloride

Systemtic Name: 8-(diethylaminomethyl)-3,7-dimethyl-purine-2,6-dione hydrochloride Openeye Name: 8-(diethylaminomethyl)-3,7-dimethyl-purine-2,6-dione hydrochloride CAS Name: 8-(diethylaminomethyl)-3,7-dimethylpurine-2,6-dione hydrochloride IUPAC Name: 8-(diethylaminomethyl)-3,7-dimethylpurine-2,6-dione hydrochloride Traditional Name: 8-(diethylaminomethyl)-3,7-dimethyl-xanthine hydrochloride Formula: C12H20ClN5O2 MolecularWeight: 301.7725

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=NC2=C(N1C)C(=O)NC(=O)N2C.Cl

Isomeric SMILES

CCN(CC)CC1=NC2=C(N1C)C(=O)NC(=O)N2C.Cl

InChI

InChI=1S/C12H19N5O2.ClH/c1-5-17(6-2)7-8-13-10-9(15(8)3)11(18)14-12(19)16(10)4;/h5-7H2,1-4H3,(H,14,18,19);1H