(6E)-6-[methoxy(oxidanyl)methylidene]-2-phenethyl-1H-pyrimidine-4,5-dione

Systemtic Name: (6E)-6-[methoxy(oxidanyl)methylidene]-2-phenethyl-1H-pyrimidine-4,5-dione Openeye Name: (6E)-6-[hydroxy(methoxy)methylene]-2-phenethyl-1H-pyrimidine-4,5-dione CAS Name: (6E)-6-[hydroxy(methoxy)methylidene]-2-phenethyl-1H-pyrimidine-4,5-dione IUPAC Name: (6E)-6-[hydroxy(methoxy)methylidene]-2-phenethyl-1H-pyrimidine-4,5-dione Traditional Name: (6E)-6-[hydroxy(methoxy)methylene]-2-phenethyl-1H-pyrimidine-4,5-quinone Formula: C14H14N2O4 MolecularWeight: 274.27196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=C1C(=O)C(=O)N=C(N1)CCC2=CC=CC=C2)O

Isomeric SMILES

CO/C(=C/1\C(=O)C(=O)N=C(N1)CCC2=CC=CC=C2)/O

InChI

InChI=1S/C14H14N2O4/c1-20-14(19)11-12(17)13(18)16-10(15-11)8-7-9-5-3-2-4-6-9/h2-6,19H,7-8H2,1H3,(H,15,16,18)/b14-11+