3-[[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino]benzoate

Systemtic Name: 3-[[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino]benzoate Openeye Name: 3-[[2-methyl-7-(trifluoromethyl)-4-quinolyl]amino]benzoate CAS Name: 3-[[2-methyl-7-(trifluoromethyl)-4-quinolinyl]amino]benzoate IUPAC Name: 3-[[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino]benzoate Traditional Name: 3-[[2-methyl-7-(trifluoromethyl)-4-quinolyl]amino]benzoate Formula: C18H12F3N2O2- MolecularWeight: 345.29529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2)C(F)(F)F)C(=C1)NC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

CC1=NC2=C(C=CC(=C2)C(F)(F)F)C(=C1)NC3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C18H13F3N2O2/c1-10-7-15(23-13-4-2-3-11(8-13)17(24)25)14-6-5-12(18(19,20)21)9-16(14)22-10/h2-9H,1H3,(H,22,23)(H,24,25)/p-1