3-(1-benzofuran-2-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-2-piperazin-1-yl-2H-quinoline-3-carboxylic acid

Systemtic Name: 3-(1-benzofuran-2-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-2-piperazin-1-yl-2H-quinoline-3-carboxylic acid Openeye Name: 3-(benzofuran-2-yl)-1-ethyl-6-fluoro-4-oxo-2-piperazin-1-yl-2H-quinoline-3-carboxylic acid CAS Name: 3-(2-benzofuranyl)-1-ethyl-6-fluoro-4-oxo-2-(1-piperazinyl)-2H-quinoline-3-carboxylic acid IUPAC Name: 3-(1-benzofuran-2-yl)-1-ethyl-6-fluoro-4-oxo-2-piperazin-1-yl-2H-quinoline-3-carboxylic acid Traditional Name: 3-(benzofuran-2-yl)-1-ethyl-6-fluoro-4-keto-2-piperazino-2H-quinoline-3-carboxylic acid Formula: C24H24FN3O4 MolecularWeight: 437.463463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(C(C(=O)C2=C1C=CC(=C2)F)(C3=CC4=CC=CC=C4O3)C(=O)O)N5CCNCC5

Isomeric SMILES

CCN1C(C(C(=O)C2=C1C=CC(=C2)F)(C3=CC4=CC=CC=C4O3)C(=O)O)N5CCNCC5

InChI

InChI=1S/C24H24FN3O4/c1-2-28-18-8-7-16(25)14-17(18)21(29)24(23(30)31,22(28)27-11-9-26-10-12-27)20-13-15-5-3-4-6-19(15)32-20/h3-8,13-14,22,26H,2,9-12H2,1H3,(H,30,31)