1-ethyl-6-fluoranyl-4-oxidanylidene-7-[4-(2-phenylethanoyl)piperazin-1-yl]quinoline-3-carboxylate

Systemtic Name: 1-ethyl-6-fluoranyl-4-oxidanylidene-7-[4-(2-phenylethanoyl)piperazin-1-yl]quinoline-3-carboxylate Openeye Name: 1-ethyl-6-fluoro-4-oxo-7-[4-(2-phenylacetyl)piperazin-1-yl]quinoline-3-carboxylate CAS Name: 1-ethyl-6-fluoro-4-oxo-7-[4-(1-oxo-2-phenylethyl)-1-piperazinyl]-3-quinolinecarboxylate IUPAC Name: 1-ethyl-6-fluoro-4-oxo-7-[4-(2-phenylacetyl)piperazin-1-yl]quinoline-3-carboxylate Traditional Name: 1-ethyl-6-fluoro-4-keto-7-[4-(2-phenylacetyl)piperazino]quinoline-3-carboxylate Formula: C24H23FN3O4- MolecularWeight: 436.455523

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)CC4=CC=CC=C4)F)C(=O)[O-]

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)CC4=CC=CC=C4)F)C(=O)[O-]

InChI

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