1,3,9-trimethyl-8-(4-phenylphenoxy)purine-2,6-dione

Systemtic Name: 1,3,9-trimethyl-8-(4-phenylphenoxy)purine-2,6-dione Openeye Name: 1,3,9-trimethyl-8-(4-phenylphenoxy)purine-2,6-dione CAS Name: 1,3,9-trimethyl-8-(4-phenylphenoxy)purine-2,6-dione IUPAC Name: 1,3,9-trimethyl-8-(4-phenylphenoxy)purine-2,6-dione Traditional Name: 1,3,9-trimethyl-8-(4-phenylphenoxy)xanthine Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C(=O)N2C)C)N=C1OC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)N(C(=O)N2C)C)N=C1OC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H18N4O3/c1-22-17-16(18(25)24(3)20(26)23(17)2)21-19(22)27-15-11-9-14(10-12-15)13-7-5-4-6-8-13/h4-12H,1-3H3