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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2)C(F)(F)F)C(=C1)NC3=CC=C(C=C3)C(=O)OCC(C)C

Isomeric SMILES

CC1=NC2=C(C=CC(=C2)C(F)(F)F)C(=C1)NC3=CC=C(C=C3)C(=O)OCC(C)C

InChI

InChI=1S/C22H21F3N2O2/c1-13(2)12-29-21(28)15-4-7-17(8-5-15)27-19-10-14(3)26-20-11-16(22(23,24)25)6-9-18(19)20/h4-11,13H,12H2,1-3H3,(H,26,27)