(5-ethoxycarbonyl-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl)methyl 4-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: (5-ethoxycarbonyl-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl)methyl 4-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: (5-ethoxycarbonyl-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl 4-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-(trifluoromethyl)-3-quinolinecarboxylic acid (5-ethoxycarbonyl-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl ester IUPAC Name: (5-ethoxycarbonyl-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl 4-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-(trifluoromethyl)quinoline-3-carboxylic acid (5-carbethoxy-2-keto-4-methyl-3,4-dihydro-1H-pyrimidin-6-yl)methyl ester Formula: C20H18F3N3O5 MolecularWeight: 437.36923

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)C2=C(C3=CC=CC=C3N=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)C2=C(C3=CC=CC=C3N=C2)C(F)(F)F

InChI

InChI=1S/C20H18F3N3O5/c1-3-30-18(28)15-10(2)25-19(29)26-14(15)9-31-17(27)12-8-24-13-7-5-4-6-11(13)16(12)20(21,22)23/h4-8,10H,3,9H2,1-2H3,(H2,25,26,29)