1-butyl-3,7-dimethyl-9H-purine-2,6,8-trione

Systemtic Name: 1-butyl-3,7-dimethyl-9H-purine-2,6,8-trione Openeye Name: 1-butyl-3,7-dimethyl-9H-purine-2,6,8-trione CAS Name: 1-butyl-3,7-dimethyl-9H-purine-2,6,8-trione IUPAC Name: 1-butyl-3,7-dimethyl-9H-purine-2,6,8-trione Traditional Name: 1-butyl-3,7-dimethyl-9H-purine-2,6,8-trione Formula: C11H16N4O3 MolecularWeight: 252.26974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(NC(=O)N2C)N(C1=O)C

Isomeric SMILES

CCCCN1C(=O)C2=C(NC(=O)N2C)N(C1=O)C

InChI

InChI=1S/C11H16N4O3/c1-4-5-6-15-9(16)7-8(14(3)11(15)18)12-10(17)13(7)2/h4-6H2,1-3H3,(H,12,17)