2-(4-tert-butylphenyl)-6-fluoranyl-3-oxidanyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(4-tert-butylphenyl)-6-fluoranyl-3-oxidanyl-quinoline-4-carboxylic acid Openeye Name: 2-(4-tert-butylphenyl)-6-fluoro-3-hydroxy-quinoline-4-carboxylic acid CAS Name: 2-(4-tert-butylphenyl)-6-fluoro-3-hydroxy-4-quinolinecarboxylic acid IUPAC Name: 2-(4-tert-butylphenyl)-6-fluoro-3-hydroxyquinoline-4-carboxylic acid Traditional Name: 2-(4-tert-butylphenyl)-6-fluoro-3-hydroxy-cinchoninic acid Formula: C20H18FNO3 MolecularWeight: 339.360223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=C3C=C(C=CC3=N2)F)C(=O)O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=C3C=C(C=CC3=N2)F)C(=O)O)O

InChI

InChI=1S/C20H18FNO3/c1-20(2,3)12-6-4-11(5-7-12)17-18(23)16(19(24)25)14-10-13(21)8-9-15(14)22-17/h4-10,23H,1-3H3,(H,24,25)