8-chloranyl-6,7-bis(fluoranyl)-1-(4-fluoranyl-3-nitro-phenyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 8-chloranyl-6,7-bis(fluoranyl)-1-(4-fluoranyl-3-nitro-phenyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 8-chloro-6,7-difluoro-1-(4-fluoro-3-nitro-phenyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 8-chloro-6,7-difluoro-1-(4-fluoro-3-nitrophenyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 8-chloro-6,7-difluoro-1-(4-fluoro-3-nitrophenyl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 8-chloro-6,7-difluoro-1-(4-fluoro-3-nitro-phenyl)-4-keto-quinoline-3-carboxylic acid Formula: C16H6ClF3N2O5 MolecularWeight: 398.67745

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N2C=C(C(=O)C3=CC(=C(C(=C32)Cl)F)F)C(=O)O)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=C(C=C1N2C=C(C(=O)C3=CC(=C(C(=C32)Cl)F)F)C(=O)O)[N+](=O)[O-])F

InChI

InChI=1S/C16H6ClF3N2O5/c17-12-13(20)10(19)4-7-14(12)21(5-8(15(7)23)16(24)25)6-1-2-9(18)11(3-6)22(26)27/h1-5H,(H,24,25)