1-[5-azanyl-2,4-bis(fluoranyl)phenyl]-7,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-[5-azanyl-2,4-bis(fluoranyl)phenyl]-7,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(5-amino-2,4-difluoro-phenyl)-7,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(5-amino-2,4-difluorophenyl)-7,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(5-amino-2,4-difluorophenyl)-7,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(5-amino-2,4-difluoro-phenyl)-7,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C16H8F4N2O3 MolecularWeight: 352.239933

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C2=C1C(=O)C(=CN2C3=CC(=C(C=C3F)F)N)C(=O)O)F)F

Isomeric SMILES

C1=CC(=C(C2=C1C(=O)C(=CN2C3=CC(=C(C=C3F)F)N)C(=O)O)F)F

InChI

InChI=1S/C16H8F4N2O3/c17-8-2-1-6-14(13(8)20)22(5-7(15(6)23)16(24)25)12-4-11(21)9(18)3-10(12)19/h1-5H,21H2,(H,24,25)