4-oxidanylidene-7-pyridin-4-yl-1-[4-(trifluoromethyl)phenyl]quinoline-3-carboxylic acid

Systemtic Name: 4-oxidanylidene-7-pyridin-4-yl-1-[4-(trifluoromethyl)phenyl]quinoline-3-carboxylic acid Openeye Name: 4-oxo-7-(4-pyridyl)-1-[4-(trifluoromethyl)phenyl]quinoline-3-carboxylic acid CAS Name: 4-oxo-7-pyridin-4-yl-1-[4-(trifluoromethyl)phenyl]-3-quinolinecarboxylic acid IUPAC Name: 4-oxo-7-pyridin-4-yl-1-[4-(trifluoromethyl)phenyl]quinoline-3-carboxylic acid Traditional Name: 4-keto-7-(4-pyridyl)-1-[4-(trifluoromethyl)phenyl]quinoline-3-carboxylic acid Formula: C22H13F3N2O3 MolecularWeight: 410.34543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(F)(F)F)N2C=C(C(=O)C3=C2C=C(C=C3)C4=CC=NC=C4)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(F)(F)F)N2C=C(C(=O)C3=C2C=C(C=C3)C4=CC=NC=C4)C(=O)O

InChI

InChI=1S/C22H13F3N2O3/c23-22(24,25)15-2-4-16(5-3-15)27-12-18(21(29)30)20(28)17-6-1-14(11-19(17)27)13-7-9-26-10-8-13/h1-12H,(H,29,30)