1-[(4-methoxyphenyl)methyl]-3,7-dimethyl-purine-2,6-dione

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-3,7-dimethyl-purine-2,6-dione Openeye Name: 1-[(4-methoxyphenyl)methyl]-3,7-dimethyl-purine-2,6-dione CAS Name: 1-[(4-methoxyphenyl)methyl]-3,7-dimethylpurine-2,6-dione IUPAC Name: 1-[(4-methoxyphenyl)methyl]-3,7-dimethylpurine-2,6-dione Traditional Name: 3,7-dimethyl-1-p-anisyl-xanthine Formula: C15H16N4O3 MolecularWeight: 300.31254

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC3=CC=C(C=C3)OC

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C15H16N4O3/c1-17-9-16-13-12(17)14(20)19(15(21)18(13)2)8-10-4-6-11(22-3)7-5-10/h4-7,9H,8H2,1-3H3