6-chloranyl-2-ethyl-8-fluoranyl-quinoline-4-carboxylic acid

Systemtic Name: 6-chloranyl-2-ethyl-8-fluoranyl-quinoline-4-carboxylic acid Openeye Name: 6-chloro-2-ethyl-8-fluoro-quinoline-4-carboxylic acid CAS Name: 6-chloro-2-ethyl-8-fluoro-4-quinolinecarboxylic acid IUPAC Name: 6-chloro-2-ethyl-8-fluoroquinoline-4-carboxylic acid Traditional Name: 6-chloro-2-ethyl-8-fluoro-cinchoninic acid Formula: C12H9ClFNO2 MolecularWeight: 253.656763

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C(C=C2C(=C1)C(=O)O)Cl)F

Isomeric SMILES

CCC1=NC2=C(C=C(C=C2C(=C1)C(=O)O)Cl)F

InChI

InChI=1S/C12H9ClFNO2/c1-2-7-5-9(12(16)17)8-3-6(13)4-10(14)11(8)15-7/h3-5H,2H2,1H3,(H,16,17)