8-[(E)-2-(3-fluorophenyl)ethenyl]-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-[(E)-2-(3-fluorophenyl)ethenyl]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-[(E)-2-(3-fluorophenyl)vinyl]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-[(E)-2-(3-fluorophenyl)ethenyl]-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-[(E)-2-(3-fluorophenyl)ethenyl]-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-[(E)-2-(3-fluorophenyl)vinyl]-1,3-dimethyl-7H-purine-2,6-quinone Formula: C15H13FN4O2 MolecularWeight: 300.287723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C=CC3=CC(=CC=C3)F

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)/C=C/C3=CC(=CC=C3)F

InChI

InChI=1S/C15H13FN4O2/c1-19-13-12(14(21)20(2)15(19)22)17-11(18-13)7-6-9-4-3-5-10(16)8-9/h3-8H,1-2H3,(H,17,18)/b7-6+