7-ethyl-8-(4-methoxyphenyl)-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-ethyl-8-(4-methoxyphenyl)-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-ethyl-8-(4-methoxyphenyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 7-ethyl-8-(4-methoxyphenyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-ethyl-8-(4-methoxyphenyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 7-ethyl-8-(4-methoxyphenyl)-1,3-dimethyl-xanthine Formula: C16H18N4O3 MolecularWeight: 314.33912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(N=C1C3=CC=C(C=C3)OC)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCN1C2=C(N=C1C3=CC=C(C=C3)OC)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C16H18N4O3/c1-5-20-12-14(18(2)16(22)19(3)15(12)21)17-13(20)10-6-8-11(23-4)9-7-10/h6-9H,5H2,1-4H3