[3-(trifluoromethyl)phenyl]methyl 2-ethyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 2-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 2-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 2-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 2-ethyl-3-methyl-cinchoninic acid [3-(trifluoromethyl)benzyl] ester Formula: C21H18F3NO2 MolecularWeight: 373.36833

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H18F3NO2/c1-3-17-13(2)19(16-9-4-5-10-18(16)25-17)20(26)27-12-14-7-6-8-15(11-14)21(22,23)24/h4-11H,3,12H2,1-2H3