6-fluoranyl-7-morpholin-4-yl-1-(4-nitrophenyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-7-morpholin-4-yl-1-(4-nitrophenyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-7-morpholino-1-(4-nitrophenyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-fluoro-7-(4-morpholinyl)-1-(4-nitrophenyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-7-morpholin-4-yl-1-(4-nitrophenyl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-7-morpholino-1-(4-nitrophenyl)quinoline-3-carboxylic acid Formula: C20H16FN3O6 MolecularWeight: 413.355943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16FN3O6/c21-16-9-14-17(10-18(16)22-5-7-30-8-6-22)23(11-15(19(14)25)20(26)27)12-1-3-13(4-2-12)24(28)29/h1-4,9-11H,5-8H2,(H,26,27)