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

Systemtic Name: methyl 4-[5-(4-methoxyphenyl)carbonyl-2-oxidanylidene-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-4-yl]benzoate Openeye Name: methyl 4-[5-(4-methoxybenzoyl)-2-oxo-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-4-yl]benzoate CAS Name: 4-[5-[(4-methoxyphenyl)-oxomethyl]-2-oxo-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-4-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-(4-methoxybenzoyl)-2-oxo-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-4-yl]benzoate Traditional Name: 4-[2-keto-5-p-anisoyl-6-(trifluoromethyl)-3,4-dihydro-1H-pyrimidin-4-yl]benzoic acid methyl ester Formula: C21H17F3N2O5 MolecularWeight: 434.36529

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2=C(NC(=O)NC2C3=CC=C(C=C3)C(=O)OC)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2=C(NC(=O)NC2C3=CC=C(C=C3)C(=O)OC)C(F)(F)F

InChI

InChI=1S/C21H17F3N2O5/c1-30-14-9-7-12(8-10-14)17(27)15-16(25-20(29)26-18(15)21(22,23)24)11-3-5-13(6-4-11)19(28)31-2/h3-10,16H,1-2H3,(H2,25,26,29)