3-[[3-ethoxycarbonyl-8-(trifluoromethyl)quinolin-4-yl]amino]benzoic acid

Systemtic Name: 3-[[3-ethoxycarbonyl-8-(trifluoromethyl)quinolin-4-yl]amino]benzoic acid Openeye Name: 3-[[3-ethoxycarbonyl-8-(trifluoromethyl)-4-quinolyl]amino]benzoic acid CAS Name: 3-[[3-ethoxycarbonyl-8-(trifluoromethyl)-4-quinolinyl]amino]benzoic acid IUPAC Name: 3-[[3-ethoxycarbonyl-8-(trifluoromethyl)quinolin-4-yl]amino]benzoic acid Traditional Name: 3-[[3-carbethoxy-8-(trifluoromethyl)-4-quinolyl]amino]benzoic acid Formula: C20H15F3N2O4 MolecularWeight: 404.33931

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1NC3=CC=CC(=C3)C(=O)O)C=CC=C2C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1NC3=CC=CC(=C3)C(=O)O)C=CC=C2C(F)(F)F

InChI

InChI=1S/C20H15F3N2O4/c1-2-29-19(28)14-10-24-17-13(7-4-8-15(17)20(21,22)23)16(14)25-12-6-3-5-11(9-12)18(26)27/h3-10H,2H2,1H3,(H,24,25)(H,26,27)