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

Systemtic Name: 1-[(3-methoxyphenyl)methyl]-3,7-dimethyl-purine-2,6-dione Openeye Name: 1-[(3-methoxyphenyl)methyl]-3,7-dimethyl-purine-2,6-dione CAS Name: 1-[(3-methoxyphenyl)methyl]-3,7-dimethylpurine-2,6-dione IUPAC Name: 1-[(3-methoxyphenyl)methyl]-3,7-dimethylpurine-2,6-dione Traditional Name: 1-m-anisyl-3,7-dimethyl-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(=CC=C3)OC

Isomeric SMILES

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

InChI

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