8-(4-ethanoylphenoxy)-1,3,7-trimethyl-purine-2,6-dione

Systemtic Name: 8-(4-ethanoylphenoxy)-1,3,7-trimethyl-purine-2,6-dione Openeye Name: 8-(4-acetylphenoxy)-1,3,7-trimethyl-purine-2,6-dione CAS Name: 8-(4-acetylphenoxy)-1,3,7-trimethylpurine-2,6-dione IUPAC Name: 8-(4-acetylphenoxy)-1,3,7-trimethylpurine-2,6-dione Traditional Name: 8-(4-acetylphenoxy)-1,3,7-trimethyl-xanthine Formula: C16H16N4O4 MolecularWeight: 328.32264

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC2=NC3=C(N2C)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC2=NC3=C(N2C)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C16H16N4O4/c1-9(21)10-5-7-11(8-6-10)24-15-17-13-12(18(15)2)14(22)20(4)16(23)19(13)3/h5-8H,1-4H3