4-[3,4-bis(fluoranyl)phenyl]-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3,5-dicarboxylate

Systemtic Name: 4-[3,4-bis(fluoranyl)phenyl]-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3,5-dicarboxylate Openeye Name: 4-(3,4-difluorophenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-3,5-dicarboxylate CAS Name: 4-(3,4-difluorophenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-3,5-dicarboxylate IUPAC Name: 4-(3,4-difluorophenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-3,5-dicarboxylate Traditional Name: 4-(3,4-difluorophenyl)-2-keto-6-methyl-1,4-dihydropyrimidine-3,5-dicarboxylate Formula: C13H8F2N2O5-2 MolecularWeight: 310.209826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1)C(=O)[O-])C2=CC(=C(C=C2)F)F)C(=O)[O-]

Isomeric SMILES

CC1=C(C(N(C(=O)N1)C(=O)[O-])C2=CC(=C(C=C2)F)F)C(=O)[O-]

InChI

InChI=1S/C13H10F2N2O5/c1-5-9(11(18)19)10(17(13(21)22)12(20)16-5)6-2-3-7(14)8(15)4-6/h2-4,10H,1H3,(H,16,20)(H,18,19)(H,21,22)/p-2