1,3-dimethyl-8-(4-phenylmethoxyphenyl)-7H-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-(4-phenylmethoxyphenyl)-7H-purine-2,6-dione Openeye Name: 8-(4-benzyloxyphenyl)-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 1,3-dimethyl-8-(4-phenylmethoxyphenyl)-7H-purine-2,6-dione IUPAC Name: 1,3-dimethyl-8-(4-phenylmethoxyphenyl)-7H-purine-2,6-dione Traditional Name: 8-(4-benzoxyphenyl)-1,3-dimethyl-7H-purine-2,6-quinone Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C20H18N4O3/c1-23-18-16(19(25)24(2)20(23)26)21-17(22-18)14-8-10-15(11-9-14)27-12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H,21,22)