methyl 4-[2-oxidanylidene-5-(phenylcarbonyl)-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-4-yl]benzoate

Systemtic Name: methyl 4-[2-oxidanylidene-5-(phenylcarbonyl)-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-4-yl]benzoate Openeye Name: methyl 4-[5-benzoyl-2-oxo-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-4-yl]benzoate CAS Name: 4-[5-benzoyl-2-oxo-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-4-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-benzoyl-2-oxo-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-4-yl]benzoate Traditional Name: 4-[5-benzoyl-2-keto-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-4-yl]benzoic acid methyl ester Formula: C20H15F3N2O4 MolecularWeight: 404.33931

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2C(=C(NC(=O)N2)C(F)(F)F)C(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2C(=C(NC(=O)N2)C(F)(F)F)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H15F3N2O4/c1-29-18(27)13-9-7-11(8-10-13)15-14(16(26)12-5-3-2-4-6-12)17(20(21,22)23)25-19(28)24-15/h2-10,15H,1H3,(H2,24,25,28)