dimethyl 2-[[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-methyl-7-(trifluoromethyl)-4-quinolyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[2-methyl-7-(trifluoromethyl)-4-quinolinyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-methyl-7-(trifluoromethyl)-4-quinolyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C21H17F3N2O4 MolecularWeight: 418.36589

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17F3N2O4/c1-11-8-16(14-7-5-13(21(22,23)24)10-18(14)25-11)26-17-9-12(19(27)29-2)4-6-15(17)20(28)30-3/h4-10H,1-3H3,(H,25,26)