6-fluoranyl-3-(2-methylpropanoyloxy)-2-(4-phenylphenyl)quinoline-4-carboxylic acid

Systemtic Name: 6-fluoranyl-3-(2-methylpropanoyloxy)-2-(4-phenylphenyl)quinoline-4-carboxylic acid Openeye Name: 6-fluoro-3-(2-methylpropanoyloxy)-2-(4-phenylphenyl)quinoline-4-carboxylic acid CAS Name: 6-fluoro-3-(2-methyl-1-oxopropoxy)-2-(4-phenylphenyl)-4-quinolinecarboxylic acid IUPAC Name: 6-fluoro-3-(2-methylpropanoyloxy)-2-(4-phenylphenyl)quinoline-4-carboxylic acid Traditional Name: 6-fluoro-3-isobutyryloxy-2-(4-phenylphenyl)cinchoninic acid Formula: C26H20FNO4 MolecularWeight: 429.439703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OC1=C(N=C2C=CC(=CC2=C1C(=O)O)F)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(=O)OC1=C(N=C2C=CC(=CC2=C1C(=O)O)F)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H20FNO4/c1-15(2)26(31)32-24-22(25(29)30)20-14-19(27)12-13-21(20)28-23(24)18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-15H,1-2H3,(H,29,30)