2,3-bis(bromanyl)-4-[5-cyano-2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]-6-methoxy-phenolate

Systemtic Name: 2,3-bis(bromanyl)-4-[5-cyano-2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]-6-methoxy-phenolate Openeye Name: 2,3-dibromo-4-(5-cyano-2,4-dioxo-1H-pyrimidin-6-yl)-6-methoxy-phenolate CAS Name: 2,3-dibromo-4-(5-cyano-2,4-dioxo-1H-pyrimidin-6-yl)-6-methoxyphenolate IUPAC Name: 2,3-dibromo-4-(5-cyano-2,4-dioxo-1H-pyrimidin-6-yl)-6-methoxyphenolate Traditional Name: 2,3-dibromo-4-(5-cyano-2,4-diketo-1H-pyrimidin-6-yl)-6-methoxy-phenolate Formula: C12H6Br2N3O4- MolecularWeight: 416.00174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C2=C(C(=O)NC(=O)N2)C#N)Br)Br)[O-]

Isomeric SMILES

COC1=C(C(=C(C(=C1)C2=C(C(=O)NC(=O)N2)C#N)Br)Br)[O-]

InChI

InChI=1S/C12H7Br2N3O4/c1-21-6-2-4(7(13)8(14)10(6)18)9-5(3-15)11(19)17-12(20)16-9/h2,18H,1H3,(H2,16,17,19,20)/p-1