butyl 4-[[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino]benzoate

Systemtic Name: butyl 4-[[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino]benzoate Openeye Name: butyl 4-[[2-methyl-7-(trifluoromethyl)-4-quinolyl]amino]benzoate CAS Name: 4-[[2-methyl-7-(trifluoromethyl)-4-quinolinyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino]benzoate Traditional Name: 4-[[2-methyl-7-(trifluoromethyl)-4-quinolyl]amino]benzoic acid butyl ester Formula: C22H21F3N2O2 MolecularWeight: 402.40955

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC2=CC(=NC3=C2C=CC(=C3)C(F)(F)F)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC2=CC(=NC3=C2C=CC(=C3)C(F)(F)F)C

InChI

InChI=1S/C22H21F3N2O2/c1-3-4-11-29-21(28)15-5-8-17(9-6-15)27-19-12-14(2)26-20-13-16(22(23,24)25)7-10-18(19)20/h5-10,12-13H,3-4,11H2,1-2H3,(H,26,27)