2-(4-tert-butylphenyl)-8-fluoranyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(4-tert-butylphenyl)-8-fluoranyl-quinoline-4-carboxylic acid Openeye Name: 2-(4-tert-butylphenyl)-8-fluoro-quinoline-4-carboxylic acid CAS Name: 2-(4-tert-butylphenyl)-8-fluoro-4-quinolinecarboxylic acid IUPAC Name: 2-(4-tert-butylphenyl)-8-fluoroquinoline-4-carboxylic acid Traditional Name: 2-(4-tert-butylphenyl)-8-fluoro-cinchoninic acid Formula: C20H18FNO2 MolecularWeight: 323.360823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=CC=C3F)C(=C2)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=CC=C3F)C(=C2)C(=O)O

InChI

InChI=1S/C20H18FNO2/c1-20(2,3)13-9-7-12(8-10-13)17-11-15(19(23)24)14-5-4-6-16(21)18(14)22-17/h4-11H,1-3H3,(H,23,24)