1-ethyl-6-fluoranyl-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-oxidanylidene-N-(phenylmethyl)quinoline-3-carboxamide

Systemtic Name: 1-ethyl-6-fluoranyl-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-oxidanylidene-N-(phenylmethyl)quinoline-3-carboxamide Openeye Name: N-benzyl-1-ethyl-6-fluoro-7-[4-(furan-2-carbonyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxamide CAS Name: 1-ethyl-6-fluoro-7-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-4-oxo-N-(phenylmethyl)-3-quinolinecarboxamide IUPAC Name: N-benzyl-1-ethyl-6-fluoro-7-[4-(furan-2-carbonyl)piperazin-1-yl]-4-oxoquinoline-3-carboxamide Traditional Name: N-benzyl-1-ethyl-6-fluoro-7-[4-(2-furoyl)piperazino]-4-keto-quinoline-3-carboxamide Formula: C28H27FN4O4 MolecularWeight: 502.536783

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C4=CC=CO4)F)C(=O)NCC5=CC=CC=C5

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C4=CC=CO4)F)C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C28H27FN4O4/c1-2-31-18-21(27(35)30-17-19-7-4-3-5-8-19)26(34)20-15-22(29)24(16-23(20)31)32-10-12-33(13-11-32)28(36)25-9-6-14-37-25/h3-9,14-16,18H,2,10-13,17H2,1H3,(H,30,35)