2,6-bis(oxidanylidene)-5-propanoyl-3-[3-(trifluoromethyl)phenyl]pyrimidin-4-olate

Systemtic Name: 2,6-bis(oxidanylidene)-5-propanoyl-3-[3-(trifluoromethyl)phenyl]pyrimidin-4-olate Openeye Name: 2,6-dioxo-5-propanoyl-3-[3-(trifluoromethyl)phenyl]pyrimidin-4-olate CAS Name: 2,6-dioxo-5-(1-oxopropyl)-3-[3-(trifluoromethyl)phenyl]-4-pyrimidinolate IUPAC Name: 2,6-dioxo-5-propanoyl-3-[3-(trifluoromethyl)phenyl]pyrimidin-4-olate Traditional Name: 2,6-diketo-5-propionyl-3-[3-(trifluoromethyl)phenyl]pyrimidin-4-olate Formula: C14H10F3N2O4- MolecularWeight: 327.23541

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(N(C(=O)NC1=O)C2=CC=CC(=C2)C(F)(F)F)[O-]

Isomeric SMILES

CCC(=O)C1=C(N(C(=O)NC1=O)C2=CC=CC(=C2)C(F)(F)F)[O-]

InChI

InChI=1S/C14H11F3N2O4/c1-2-9(20)10-11(21)18-13(23)19(12(10)22)8-5-3-4-7(6-8)14(15,16)17/h3-6,22H,2H2,1H3,(H,18,21,23)/p-1