ethyl 2-acetyloxy-5-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1H-pyrimidin-3-yl]benzoate

Systemtic Name: ethyl 2-acetyloxy-5-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1H-pyrimidin-3-yl]benzoate Openeye Name: ethyl 2-acetoxy-5-[2,4-dioxo-6-(trifluoromethyl)-1H-pyrimidin-3-yl]benzoate CAS Name: 2-acetyloxy-5-[2,4-dioxo-6-(trifluoromethyl)-1H-pyrimidin-3-yl]benzoic acid ethyl ester IUPAC Name: ethyl 2-acetyloxy-5-[2,4-dioxo-6-(trifluoromethyl)-1H-pyrimidin-3-yl]benzoate Traditional Name: 2-acetoxy-5-[2,4-diketo-6-(trifluoromethyl)-1H-pyrimidin-3-yl]benzoic acid ethyl ester Formula: C16H13F3N2O6 MolecularWeight: 386.27943

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)N2C(=O)C=C(NC2=O)C(F)(F)F)OC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)N2C(=O)C=C(NC2=O)C(F)(F)F)OC(=O)C

InChI

InChI=1S/C16H13F3N2O6/c1-3-26-14(24)10-6-9(4-5-11(10)27-8(2)22)21-13(23)7-12(16(17,18)19)20-15(21)25/h4-7H,3H2,1-2H3,(H,20,25)