6-[bis(oxidanyl)methylidene]-2-[(3-bromanyl-4-methoxy-phenyl)methyl]-1H-pyrimidine-4,5-dione

Systemtic Name: 6-[bis(oxidanyl)methylidene]-2-[(3-bromanyl-4-methoxy-phenyl)methyl]-1H-pyrimidine-4,5-dione Openeye Name: 2-[(3-bromo-4-methoxy-phenyl)methyl]-6-(dihydroxymethylene)-1H-pyrimidine-4,5-dione CAS Name: 2-[(3-bromo-4-methoxyphenyl)methyl]-6-(dihydroxymethylidene)-1H-pyrimidine-4,5-dione IUPAC Name: 2-[(3-bromo-4-methoxyphenyl)methyl]-6-(dihydroxymethylidene)-1H-pyrimidine-4,5-dione Traditional Name: 2-(3-bromo-4-methoxy-benzyl)-6-(dihydroxymethylene)-1H-pyrimidine-4,5-quinone Formula: C13H11BrN2O5 MolecularWeight: 355.14084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NC(=O)C(=O)C(=C(O)O)N2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NC(=O)C(=O)C(=C(O)O)N2)Br

InChI

InChI=1S/C13H11BrN2O5/c1-21-8-3-2-6(4-7(8)14)5-9-15-10(13(19)20)11(17)12(18)16-9/h2-4,19-20H,5H2,1H3,(H,15,16,18)