potassium 3-ethyl-7-methyl-purine-2,6-dione

Systemtic Name: potassium 3-ethyl-7-methyl-purine-2,6-dione Openeye Name: potassium 3-ethyl-7-methyl-purine-2,6-dione CAS Name: potassium 3-ethyl-7-methylpurine-2,6-dione IUPAC Name: potassium 3-ethyl-7-methylpurine-2,6-dione Traditional Name: potassium 3-ethyl-7-methyl-xanthine Formula: C8H10KN4O2+ MolecularWeight: 233.2889

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)NC1=O)N(C=N2)C.[K+]

Isomeric SMILES

CCN1C2=C(C(=O)NC1=O)N(C=N2)C.[K+]

InChI

InChI=1S/C8H10N4O2.K/c1-3-12-6-5(11(2)4-9-6)7(13)10-8(12)14;/h4H,3H2,1-2H3,(H,10,13,14);/q;+1