7-butyl-8-(4-fluoranylphenoxy)-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-butyl-8-(4-fluoranylphenoxy)-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-butyl-8-(4-fluorophenoxy)-1,3-dimethyl-purine-2,6-dione CAS Name: 7-butyl-8-(4-fluorophenoxy)-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-butyl-8-(4-fluorophenoxy)-1,3-dimethylpurine-2,6-dione Traditional Name: 7-butyl-8-(4-fluorophenoxy)-1,3-dimethyl-xanthine Formula: C17H19FN4O3 MolecularWeight: 346.356163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(N=C1OC3=CC=C(C=C3)F)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCCCN1C2=C(N=C1OC3=CC=C(C=C3)F)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C17H19FN4O3/c1-4-5-10-22-13-14(20(2)17(24)21(3)15(13)23)19-16(22)25-12-8-6-11(18)7-9-12/h6-9H,4-5,10H2,1-3H3