3-azanyl-6-fluoranyl-2-[4-(2-fluorophenyl)phenyl]quinoline-4-carboxylic acid

Systemtic Name: 3-azanyl-6-fluoranyl-2-[4-(2-fluorophenyl)phenyl]quinoline-4-carboxylic acid Openeye Name: 3-amino-6-fluoro-2-[4-(2-fluorophenyl)phenyl]quinoline-4-carboxylic acid CAS Name: 3-amino-6-fluoro-2-[4-(2-fluorophenyl)phenyl]-4-quinolinecarboxylic acid IUPAC Name: 3-amino-6-fluoro-2-[4-(2-fluorophenyl)phenyl]quinoline-4-carboxylic acid Traditional Name: 3-amino-6-fluoro-2-[4-(2-fluorophenyl)phenyl]cinchoninic acid Formula: C22H14F2N2O2 MolecularWeight: 376.355566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)C3=C(C(=C4C=C(C=CC4=N3)F)C(=O)O)N)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)C3=C(C(=C4C=C(C=CC4=N3)F)C(=O)O)N)F

InChI

InChI=1S/C22H14F2N2O2/c23-14-9-10-18-16(11-14)19(22(27)28)20(25)21(26-18)13-7-5-12(6-8-13)15-3-1-2-4-17(15)24/h1-11H,25H2,(H,27,28)