7-[2-(6-ethoxy-2,2,4-trimethyl-quinolin-1-yl)-2-oxidanylidene-ethyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[2-(6-ethoxy-2,2,4-trimethyl-quinolin-1-yl)-2-oxidanylidene-ethyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[2-(6-ethoxy-2,2,4-trimethyl-1-quinolyl)-2-oxo-ethyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[2-(6-ethoxy-2,2,4-trimethyl-1-quinolinyl)-2-oxoethyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[2-(6-ethoxy-2,2,4-trimethylquinolin-1-yl)-2-oxoethyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[2-(6-ethoxy-2,2,4-trimethyl-1-quinolyl)-2-keto-ethyl]-1,3-dimethyl-xanthine Formula: C23H27N5O4 MolecularWeight: 437.49158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(C=C2C)(C)C)C(=O)CN3C=NC4=C3C(=O)N(C(=O)N4C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(C=C2C)(C)C)C(=O)CN3C=NC4=C3C(=O)N(C(=O)N4C)C

InChI

InChI=1S/C23H27N5O4/c1-7-32-15-8-9-17-16(10-15)14(2)11-23(3,4)28(17)18(29)12-27-13-24-20-19(27)21(30)26(6)22(31)25(20)5/h8-11,13H,7,12H2,1-6H3