1-(3-azanyl-4-fluoranyl-phenyl)-8-chloranyl-6-fluoranyl-7-(methylamino)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-(3-azanyl-4-fluoranyl-phenyl)-8-chloranyl-6-fluoranyl-7-(methylamino)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(3-amino-4-fluoro-phenyl)-8-chloro-6-fluoro-7-(methylamino)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(3-amino-4-fluorophenyl)-8-chloro-6-fluoro-7-(methylamino)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(3-amino-4-fluorophenyl)-8-chloro-6-fluoro-7-(methylamino)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(3-amino-4-fluoro-phenyl)-8-chloro-6-fluoro-4-keto-7-(methylamino)quinoline-3-carboxylic acid Formula: C17H12ClF2N3O3 MolecularWeight: 379.745286

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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=C3)F)N)F

Isomeric SMILES

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

InChI

InChI=1S/C17H12ClF2N3O3/c1-22-14-11(20)5-8-15(13(14)18)23(6-9(16(8)24)17(25)26)7-2-3-10(19)12(21)4-7/h2-6,22H,21H2,1H3,(H,25,26)