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

Systemtic Name: 1-ethyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-N-octyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-N-octyl-4-oxo-quinoline-3-carboxamide CAS Name: 1-ethyl-6-fluoro-7-(4-methyl-1-piperazinyl)-N-octyl-4-oxo-3-quinolinecarboxamide IUPAC Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-N-octyl-4-oxoquinoline-3-carboxamide Traditional Name: 1-ethyl-6-fluoro-4-keto-7-(4-methylpiperazino)-N-octyl-quinoline-3-carboxamide Formula: C25H37FN4O2 MolecularWeight: 444.585283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H37FN4O2/c1-4-6-7-8-9-10-11-27-25(32)20-18-29(5-2)22-17-23(21(26)16-19(22)24(20)31)30-14-12-28(3)13-15-30/h16-18H,4-15H2,1-3H3,(H,27,32)