3,7-diethyl-1-(2-hydroxyethyl)purine-2,6-dione

Systemtic Name: 3,7-diethyl-1-(2-hydroxyethyl)purine-2,6-dione Openeye Name: 3,7-diethyl-1-(2-hydroxyethyl)purine-2,6-dione CAS Name: 3,7-diethyl-1-(2-hydroxyethyl)purine-2,6-dione IUPAC Name: 3,7-diethyl-1-(2-hydroxyethyl)purine-2,6-dione Traditional Name: 3,7-diethyl-1-(2-hydroxyethyl)xanthine Formula: C11H16N4O3 MolecularWeight: 252.26974

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1C(=O)N(C(=O)N2CC)CCO

Isomeric SMILES

CCN1C=NC2=C1C(=O)N(C(=O)N2CC)CCO

InChI

InChI=1S/C11H16N4O3/c1-3-13-7-12-9-8(13)10(17)15(5-6-16)11(18)14(9)4-2/h7,16H,3-6H2,1-2H3