2-(4-tert-butylphenyl)-6-chloranyl-8-fluoranyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(4-tert-butylphenyl)-6-chloranyl-8-fluoranyl-quinoline-4-carboxylic acid Openeye Name: 2-(4-tert-butylphenyl)-6-chloro-8-fluoro-quinoline-4-carboxylic acid CAS Name: 2-(4-tert-butylphenyl)-6-chloro-8-fluoro-4-quinolinecarboxylic acid IUPAC Name: 2-(4-tert-butylphenyl)-6-chloro-8-fluoroquinoline-4-carboxylic acid Traditional Name: 2-(4-tert-butylphenyl)-6-chloro-8-fluoro-cinchoninic acid Formula: C20H17ClFNO2 MolecularWeight: 357.805883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)O)Cl)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)O)Cl)F

InChI

InChI=1S/C20H17ClFNO2/c1-20(2,3)12-6-4-11(5-7-12)17-10-15(19(24)25)14-8-13(21)9-16(22)18(14)23-17/h4-10H,1-3H3,(H,24,25)