1-[5-azanyl-2,4-bis(fluoranyl)phenyl]-8-chloranyl-6-fluoranyl-4-oxidanylidene-7-[[3,3,3-tris(fluoranyl)-2-oxidanyl-propyl]amino]quinoline-3-carboxylic acid

Systemtic Name: 1-[5-azanyl-2,4-bis(fluoranyl)phenyl]-8-chloranyl-6-fluoranyl-4-oxidanylidene-7-[[3,3,3-tris(fluoranyl)-2-oxidanyl-propyl]amino]quinoline-3-carboxylic acid Openeye Name: 1-(5-amino-2,4-difluoro-phenyl)-8-chloro-6-fluoro-4-oxo-7-[(3,3,3-trifluoro-2-hydroxy-propyl)amino]quinoline-3-carboxylic acid CAS Name: 1-(5-amino-2,4-difluorophenyl)-8-chloro-6-fluoro-4-oxo-7-[(3,3,3-trifluoro-2-hydroxypropyl)amino]-3-quinolinecarboxylic acid IUPAC Name: 1-(5-amino-2,4-difluorophenyl)-8-chloro-6-fluoro-4-oxo-7-[(3,3,3-trifluoro-2-hydroxypropyl)amino]quinoline-3-carboxylic acid Traditional Name: 1-(5-amino-2,4-difluoro-phenyl)-8-chloro-6-fluoro-4-keto-7-[(3,3,3-trifluoro-2-hydroxy-propyl)amino]quinoline-3-carboxylic acid Formula: C19H12ClF6N3O4 MolecularWeight: 495.759699

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=C(C(=C1F)NCC(C(F)(F)F)O)Cl)N(C=C(C2=O)C(=O)O)C3=CC(=C(C=C3F)F)N

Isomeric SMILES

C1=C2C(=C(C(=C1F)NCC(C(F)(F)F)O)Cl)N(C=C(C2=O)C(=O)O)C3=CC(=C(C=C3F)F)N

InChI

InChI=1S/C19H12ClF6N3O4/c20-14-15(28-4-13(30)19(24,25)26)10(23)1-6-16(14)29(5-7(17(6)31)18(32)33)12-3-11(27)8(21)2-9(12)22/h1-3,5,13,28,30H,4,27H2,(H,32,33)