8-bromanyl-2-(4-fluorophenyl)quinoline-4-carboxylic acid

Systemtic Name: 8-bromanyl-2-(4-fluorophenyl)quinoline-4-carboxylic acid Openeye Name: 8-bromo-2-(4-fluorophenyl)quinoline-4-carboxylic acid CAS Name: 8-bromo-2-(4-fluorophenyl)-4-quinolinecarboxylic acid IUPAC Name: 8-bromo-2-(4-fluorophenyl)quinoline-4-carboxylic acid Traditional Name: 8-bromo-2-(4-fluorophenyl)cinchoninic acid Formula: C16H9BrFNO2 MolecularWeight: 346.150563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Br)N=C(C=C2C(=O)O)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC2=C(C(=C1)Br)N=C(C=C2C(=O)O)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H9BrFNO2/c17-13-3-1-2-11-12(16(20)21)8-14(19-15(11)13)9-4-6-10(18)7-5-9/h1-8H,(H,20,21)