6-fluoranyl-1-(2-fluoranyl-4-nitro-phenyl)-7-morpholin-4-yl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-1-(2-fluoranyl-4-nitro-phenyl)-7-morpholin-4-yl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-1-(2-fluoro-4-nitro-phenyl)-7-morpholino-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(2-fluoro-4-nitrophenyl)-7-(4-morpholinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-1-(2-fluoro-4-nitrophenyl)-7-morpholin-4-yl-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-fluoro-1-(2-fluoro-4-nitro-phenyl)-4-keto-7-morpholino-quinoline-3-carboxylic acid Formula: C20H15F2N3O6 MolecularWeight: 431.346406

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=C(C=C(C=C4)[N+](=O)[O-])F)F

Isomeric SMILES

C1COCCN1C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=C(C=C(C=C4)[N+](=O)[O-])F)F

InChI

InChI=1S/C20H15F2N3O6/c21-14-7-11(25(29)30)1-2-16(14)24-10-13(20(27)28)19(26)12-8-15(22)18(9-17(12)24)23-3-5-31-6-4-23/h1-2,7-10H,3-6H2,(H,27,28)