4-[[3-chloranyl-2,4-bis(fluoranyl)phenyl]carbamoyl]-1-methyl-6-oxidanylidene-pyrimidin-2-olate

Systemtic Name: 4-[[3-chloranyl-2,4-bis(fluoranyl)phenyl]carbamoyl]-1-methyl-6-oxidanylidene-pyrimidin-2-olate Openeye Name: 4-[(3-chloro-2,4-difluoro-phenyl)carbamoyl]-1-methyl-6-oxo-pyrimidin-2-olate CAS Name: 4-[(3-chloro-2,4-difluoroanilino)-oxomethyl]-1-methyl-6-oxo-2-pyrimidinolate IUPAC Name: 4-[(3-chloro-2,4-difluorophenyl)carbamoyl]-1-methyl-6-oxopyrimidin-2-olate Traditional Name: 4-[(3-chloro-2,4-difluoro-phenyl)carbamoyl]-6-keto-1-methyl-pyrimidin-2-olate Formula: C12H7ClF2N3O3- MolecularWeight: 314.652086

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1[O-])C(=O)NC2=C(C(=C(C=C2)F)Cl)F

Isomeric SMILES

CN1C(=O)C=C(N=C1[O-])C(=O)NC2=C(C(=C(C=C2)F)Cl)F

InChI

InChI=1S/C12H8ClF2N3O3/c1-18-8(19)4-7(17-12(18)21)11(20)16-6-3-2-5(14)9(13)10(6)15/h2-4H,1H3,(H,16,20)(H,17,21)/p-1