1-ethyl-7-(2-phenoxyethyl)-3-phenyl-purine-2,6-dione

Systemtic Name: 1-ethyl-7-(2-phenoxyethyl)-3-phenyl-purine-2,6-dione Openeye Name: 1-ethyl-7-(2-phenoxyethyl)-3-phenyl-purine-2,6-dione CAS Name: 1-ethyl-7-(2-phenoxyethyl)-3-phenylpurine-2,6-dione IUPAC Name: 1-ethyl-7-(2-phenoxyethyl)-3-phenylpurine-2,6-dione Traditional Name: 1-ethyl-7-(2-phenoxyethyl)-3-phenyl-xanthine Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=CN2CCOC3=CC=CC=C3)N(C1=O)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=O)C2=C(N=CN2CCOC3=CC=CC=C3)N(C1=O)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O3/c1-2-24-20(26)18-19(25(21(24)27)16-9-5-3-6-10-16)22-15-23(18)13-14-28-17-11-7-4-8-12-17/h3-12,15H,2,13-14H2,1H3