methyl 4-[[2-(trifluoromethyl)quinolin-4-yl]methyl]benzoate

Systemtic Name: methyl 4-[[2-(trifluoromethyl)quinolin-4-yl]methyl]benzoate Openeye Name: methyl 4-[[2-(trifluoromethyl)-4-quinolyl]methyl]benzoate CAS Name: 4-[[2-(trifluoromethyl)-4-quinolinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(trifluoromethyl)quinolin-4-yl]methyl]benzoate Traditional Name: 4-[[2-(trifluoromethyl)-4-quinolyl]methyl]benzoic acid methyl ester Formula: C19H14F3NO2 MolecularWeight: 345.31517

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CC2=CC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CC2=CC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C19H14F3NO2/c1-25-18(24)13-8-6-12(7-9-13)10-14-11-17(19(20,21)22)23-16-5-3-2-4-15(14)16/h2-9,11H,10H2,1H3