8-bromanyl-1-ethyl-6,7-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 8-bromanyl-1-ethyl-6,7-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 8-bromo-1-ethyl-6,7-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 8-bromo-1-ethyl-6,7-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 8-bromo-1-ethyl-6,7-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 8-bromo-1-ethyl-6,7-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C12H8BrF2NO3 MolecularWeight: 332.097626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)Br)F)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)Br)F)F)C(=O)O

InChI

InChI=1S/C12H8BrF2NO3/c1-2-16-4-6(12(18)19)11(17)5-3-7(14)9(15)8(13)10(5)16/h3-4H,2H2,1H3,(H,18,19)