1-ethyl-6-fluoranyl-7-(2-morpholin-4-yl-1,3-thiazol-4-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-7-(2-morpholin-4-yl-1,3-thiazol-4-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-7-(2-morpholinothiazol-4-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-7-[2-(4-morpholinyl)-4-thiazolyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-7-(2-morpholin-4-yl-1,3-thiazol-4-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-4-keto-7-(2-morpholinothiazol-4-yl)quinoline-3-carboxylic acid Formula: C19H18FN3O4S MolecularWeight: 403.427323

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=CSC(=N3)N4CCOCC4)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=CSC(=N3)N4CCOCC4)F)C(=O)O

InChI

InChI=1S/C19H18FN3O4S/c1-2-22-9-13(18(25)26)17(24)12-7-14(20)11(8-16(12)22)15-10-28-19(21-15)23-3-5-27-6-4-23/h7-10H,2-6H2,1H3,(H,25,26)