3-[[4-oxidanylidene-8-(trifluoromethyl)-1H-quinolin-3-yl]carbonylamino]benzoic acid

Systemtic Name: 3-[[4-oxidanylidene-8-(trifluoromethyl)-1H-quinolin-3-yl]carbonylamino]benzoic acid Openeye Name: 3-[[4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carbonyl]amino]benzoic acid CAS Name: 3-[[oxo-[4-oxo-8-(trifluoromethyl)-1H-quinolin-3-yl]methyl]amino]benzoic acid IUPAC Name: 3-[[4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carbonyl]amino]benzoic acid Traditional Name: 3-[[4-keto-8-(trifluoromethyl)-1H-quinoline-3-carbonyl]amino]benzoic acid Formula: C18H11F3N2O4 MolecularWeight: 376.28615

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CNC3=C(C2=O)C=CC=C3C(F)(F)F)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CNC3=C(C2=O)C=CC=C3C(F)(F)F)C(=O)O

InChI

InChI=1S/C18H11F3N2O4/c19-18(20,21)13-6-2-5-11-14(13)22-8-12(15(11)24)16(25)23-10-4-1-3-9(7-10)17(26)27/h1-8H,(H,22,24)(H,23,25)(H,26,27)