8-(4-fluoranylphenoxy)-1,3-dimethyl-9-propan-2-yl-purine-2,6-dione

Systemtic Name: 8-(4-fluoranylphenoxy)-1,3-dimethyl-9-propan-2-yl-purine-2,6-dione Openeye Name: 8-(4-fluorophenoxy)-9-isopropyl-1,3-dimethyl-purine-2,6-dione CAS Name: 8-(4-fluorophenoxy)-1,3-dimethyl-9-propan-2-ylpurine-2,6-dione IUPAC Name: 8-(4-fluorophenoxy)-1,3-dimethyl-9-propan-2-ylpurine-2,6-dione Traditional Name: 8-(4-fluorophenoxy)-9-isopropyl-1,3-dimethyl-xanthine Formula: C16H17FN4O3 MolecularWeight: 332.329583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C(=O)N(C(=O)N2C)C)N=C1OC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)N1C2=C(C(=O)N(C(=O)N2C)C)N=C1OC3=CC=C(C=C3)F

InChI

InChI=1S/C16H17FN4O3/c1-9(2)21-13-12(14(22)20(4)16(23)19(13)3)18-15(21)24-11-7-5-10(17)6-8-11/h5-9H,1-4H3