1,3-diethyl-8-[(E)-2-(4-methoxy-3-methyl-phenyl)ethenyl]-7H-purine-2,6-dione

Systemtic Name: 1,3-diethyl-8-[(E)-2-(4-methoxy-3-methyl-phenyl)ethenyl]-7H-purine-2,6-dione Openeye Name: 1,3-diethyl-8-[(E)-2-(4-methoxy-3-methyl-phenyl)vinyl]-7H-purine-2,6-dione CAS Name: 1,3-diethyl-8-[(E)-2-(4-methoxy-3-methylphenyl)ethenyl]-7H-purine-2,6-dione IUPAC Name: 1,3-diethyl-8-[(E)-2-(4-methoxy-3-methylphenyl)ethenyl]-7H-purine-2,6-dione Traditional Name: 1,3-diethyl-8-[(E)-2-(4-methoxy-3-methyl-phenyl)vinyl]-7H-purine-2,6-quinone Formula: C19H22N4O3 MolecularWeight: 354.40298

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N(C1=O)CC)NC(=N2)C=CC3=CC(=C(C=C3)OC)C

Isomeric SMILES

CCN1C2=C(C(=O)N(C1=O)CC)NC(=N2)/C=C/C3=CC(=C(C=C3)OC)C

InChI

InChI=1S/C19H22N4O3/c1-5-22-17-16(18(24)23(6-2)19(22)25)20-15(21-17)10-8-13-7-9-14(26-4)12(3)11-13/h7-11H,5-6H2,1-4H3,(H,20,21)/b10-8+