1-ethyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-N-pentyl-quinoline-3-carboxamide

Systemtic Name: 1-ethyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-N-pentyl-quinoline-3-carboxamide Openeye Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-pentyl-quinoline-3-carboxamide CAS Name: 1-ethyl-6-fluoro-7-(4-methyl-1-piperazinyl)-4-oxo-N-pentyl-3-quinolinecarboxamide IUPAC Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-pentylquinoline-3-carboxamide Traditional Name: N-amyl-1-ethyl-6-fluoro-4-keto-7-(4-methylpiperazino)quinoline-3-carboxamide Formula: C22H31FN4O2 MolecularWeight: 402.505543

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)N3CCN(CC3)C)CC

Isomeric SMILES

CCCCCNC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)N3CCN(CC3)C)CC

InChI

InChI=1S/C22H31FN4O2/c1-4-6-7-8-24-22(29)17-15-26(5-2)19-14-20(18(23)13-16(19)21(17)28)27-11-9-25(3)10-12-27/h13-15H,4-12H2,1-3H3,(H,24,29)