1-(2-hydroxyethyl)-4-oxidanylidene-6-[[2-(trifluoromethyloxy)phenyl]methyl]quinoline-3-carboxylic acid

Systemtic Name: 1-(2-hydroxyethyl)-4-oxidanylidene-6-[[2-(trifluoromethyloxy)phenyl]methyl]quinoline-3-carboxylic acid Openeye Name: 1-(2-hydroxyethyl)-4-oxo-6-[[2-(trifluoromethoxy)phenyl]methyl]quinoline-3-carboxylic acid CAS Name: 1-(2-hydroxyethyl)-4-oxo-6-[[2-(trifluoromethoxy)phenyl]methyl]-3-quinolinecarboxylic acid IUPAC Name: 1-(2-hydroxyethyl)-4-oxo-6-[[2-(trifluoromethoxy)phenyl]methyl]quinoline-3-carboxylic acid Traditional Name: 1-(2-hydroxyethyl)-4-keto-6-[2-(trifluoromethoxy)benzyl]quinoline-3-carboxylic acid Formula: C20H16F3NO5 MolecularWeight: 407.33995

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=CC3=C(C=C2)N(C=C(C3=O)C(=O)O)CCO)OC(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)CC2=CC3=C(C=C2)N(C=C(C3=O)C(=O)O)CCO)OC(F)(F)F

InChI

InChI=1S/C20H16F3NO5/c21-20(22,23)29-17-4-2-1-3-13(17)9-12-5-6-16-14(10-12)18(26)15(19(27)28)11-24(16)7-8-25/h1-6,10-11,25H,7-9H2,(H,27,28)