7-ethyl-1,3,8-trimethyl-purine-2,6-dione; N-propylpropan-1-amine; hydrochloride

Systemtic Name: 7-ethyl-1,3,8-trimethyl-purine-2,6-dione; N-propylpropan-1-amine; hydrochloride Openeye Name: 7-ethyl-1,3,8-trimethyl-purine-2,6-dione; N-propylpropan-1-amine; hydrochloride CAS Name: 7-ethyl-1,3,8-trimethylpurine-2,6-dione; N-propyl-1-propanamine; hydrochloride IUPAC Name: 7-ethyl-1,3,8-trimethylpurine-2,6-dione; N-propylpropan-1-amine; hydrochloride Traditional Name: dipropylamine; 7-ethyl-1,3,8-trimethyl-xanthine; hydrochloride Formula: C16H30ClN5O2 MolecularWeight: 359.8947

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCCC.CCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)C.Cl

Isomeric SMILES

CCCNCCC.CCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)C.Cl

InChI

InChI=1S/C10H14N4O2.C6H15N.ClH/c1-5-14-6(2)11-8-7(14)9(15)13(4)10(16)12(8)3;1-3-5-7-6-4-2;/h5H2,1-4H3;7H,3-6H2,1-2H3;1H