1-[2,4-bis(fluoranyl)-5-methoxy-phenyl]-8-chloranyl-6-fluoranyl-7-(methylamino)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-[2,4-bis(fluoranyl)-5-methoxy-phenyl]-8-chloranyl-6-fluoranyl-7-(methylamino)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 8-chloro-1-(2,4-difluoro-5-methoxy-phenyl)-6-fluoro-7-(methylamino)-4-oxo-quinoline-3-carboxylic acid CAS Name: 8-chloro-1-(2,4-difluoro-5-methoxyphenyl)-6-fluoro-7-(methylamino)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 8-chloro-1-(2,4-difluoro-5-methoxyphenyl)-6-fluoro-7-(methylamino)-4-oxoquinoline-3-carboxylic acid Traditional Name: 8-chloro-1-(2,4-difluoro-5-methoxy-phenyl)-6-fluoro-4-keto-7-(methylamino)quinoline-3-carboxylic acid Formula: C18H12ClF3N2O4 MolecularWeight: 412.74709

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C2C(=C1Cl)N(C=C(C2=O)C(=O)O)C3=CC(=C(C=C3F)F)OC)F

Isomeric SMILES

CNC1=C(C=C2C(=C1Cl)N(C=C(C2=O)C(=O)O)C3=CC(=C(C=C3F)F)OC)F

InChI

InChI=1S/C18H12ClF3N2O4/c1-23-15-11(22)3-7-16(14(15)19)24(6-8(17(7)25)18(26)27)12-5-13(28-2)10(21)4-9(12)20/h3-6,23H,1-2H3,(H,26,27)