2-[2,5-bis(fluoranyl)phenyl]-8-bromanyl-quinoline-4-carboxylic acid

Systemtic Name: 2-[2,5-bis(fluoranyl)phenyl]-8-bromanyl-quinoline-4-carboxylic acid Openeye Name: 8-bromo-2-(2,5-difluorophenyl)quinoline-4-carboxylic acid CAS Name: 8-bromo-2-(2,5-difluorophenyl)-4-quinolinecarboxylic acid IUPAC Name: 8-bromo-2-(2,5-difluorophenyl)quinoline-4-carboxylic acid Traditional Name: 8-bromo-2-(2,5-difluorophenyl)cinchoninic acid Formula: C16H8BrF2NO2 MolecularWeight: 364.141026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H8BrF2NO2/c17-12-3-1-2-9-10(16(21)22)7-14(20-15(9)12)11-6-8(18)4-5-13(11)19/h1-7H,(H,21,22)