1-[(2-ethoxyphenyl)methyl]-3-(2-methylphenyl)-7H-purine-2,6-dione

Systemtic Name: 1-[(2-ethoxyphenyl)methyl]-3-(2-methylphenyl)-7H-purine-2,6-dione Openeye Name: 1-[(2-ethoxyphenyl)methyl]-3-(o-tolyl)-7H-purine-2,6-dione CAS Name: 1-[(2-ethoxyphenyl)methyl]-3-(2-methylphenyl)-7H-purine-2,6-dione IUPAC Name: 1-[(2-ethoxyphenyl)methyl]-3-(2-methylphenyl)-7H-purine-2,6-dione Traditional Name: 1-(2-ethoxybenzyl)-3-(o-tolyl)-7H-purine-2,6-quinone Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CN2C(=O)C3=C(N=CN3)N(C2=O)C4=CC=CC=C4C

Isomeric SMILES

CCOC1=CC=CC=C1CN2C(=O)C3=C(N=CN3)N(C2=O)C4=CC=CC=C4C

InChI

InChI=1S/C21H20N4O3/c1-3-28-17-11-7-5-9-15(17)12-24-20(26)18-19(23-13-22-18)25(21(24)27)16-10-6-4-8-14(16)2/h4-11,13H,3,12H2,1-2H3,(H,22,23)