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

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-7H-purine-2,6-dione Openeye Name: 3-[(4-methoxyphenyl)methyl]-7H-purine-2,6-dione CAS Name: 3-[(4-methoxyphenyl)methyl]-7H-purine-2,6-dione IUPAC Name: 3-[(4-methoxyphenyl)methyl]-7H-purine-2,6-dione Traditional Name: 3-p-anisyl-7H-purine-2,6-quinone Formula: C13H12N4O3 MolecularWeight: 272.25938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C3=C(C(=O)NC2=O)NC=N3

Isomeric SMILES

COC1=CC=C(C=C1)CN2C3=C(C(=O)NC2=O)NC=N3

InChI

InChI=1S/C13H12N4O3/c1-20-9-4-2-8(3-5-9)6-17-11-10(14-7-15-11)12(18)16-13(17)19/h2-5,7H,6H2,1H3,(H,14,15)(H,16,18,19)