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

Systemtic Name: 1-(4-azanyl-2-fluoranyl-phenyl)-6-fluoranyl-7-morpholin-4-yl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(4-amino-2-fluoro-phenyl)-6-fluoro-7-morpholino-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(4-amino-2-fluorophenyl)-6-fluoro-7-(4-morpholinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(4-amino-2-fluorophenyl)-6-fluoro-7-morpholin-4-yl-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(4-amino-2-fluoro-phenyl)-6-fluoro-4-keto-7-morpholino-quinoline-3-carboxylic acid Formula: C20H17F2N3O4 MolecularWeight: 401.363486

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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)F)F

Isomeric SMILES

C1COCCN1C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=C(C=C(C=C4)N)F)F

InChI

InChI=1S/C20H17F2N3O4/c21-14-7-11(23)1-2-16(14)25-10-13(20(27)28)19(26)12-8-15(22)18(9-17(12)25)24-3-5-29-6-4-24/h1-2,7-10H,3-6,23H2,(H,27,28)