7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-N-(2-methylpropyl)-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: 7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-N-(2-methylpropyl)-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 7-(4-acetylpiperazin-1-yl)-1-ethyl-6-fluoro-N-isobutyl-4-oxo-quinoline-3-carboxamide CAS Name: 7-(4-acetyl-1-piperazinyl)-1-ethyl-6-fluoro-N-(2-methylpropyl)-4-oxo-3-quinolinecarboxamide IUPAC Name: 7-(4-acetylpiperazin-1-yl)-1-ethyl-6-fluoro-N-(2-methylpropyl)-4-oxoquinoline-3-carboxamide Traditional Name: 7-(4-acetylpiperazino)-1-ethyl-6-fluoro-N-isobutyl-4-keto-quinoline-3-carboxamide Formula: C22H29FN4O3 MolecularWeight: 416.489063

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C)F)C(=O)NCC(C)C

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C)F)C(=O)NCC(C)C

InChI

InChI=1S/C22H29FN4O3/c1-5-25-13-17(22(30)24-12-14(2)3)21(29)16-10-18(23)20(11-19(16)25)27-8-6-26(7-9-27)15(4)28/h10-11,13-14H,5-9,12H2,1-4H3,(H,24,30)