7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-N-[(2S)-pentan-2-yl]quinoline-3-carboxamide

Systemtic Name: 7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-N-[(2S)-pentan-2-yl]quinoline-3-carboxamide Openeye Name: 7-(4-acetylpiperazin-1-yl)-1-ethyl-6-fluoro-N-[(1S)-1-methylbutyl]-4-oxo-quinoline-3-carboxamide CAS Name: 7-(4-acetyl-1-piperazinyl)-1-ethyl-6-fluoro-4-oxo-N-[(2S)-pentan-2-yl]-3-quinolinecarboxamide IUPAC Name: 7-(4-acetylpiperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-N-[(2S)-pentan-2-yl]quinoline-3-carboxamide Traditional Name: 7-(4-acetylpiperazino)-1-ethyl-6-fluoro-4-keto-N-[(1S)-1-methylbutyl]quinoline-3-carboxamide Formula: C23H31FN4O3 MolecularWeight: 430.515643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC[C@H](C)NC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)N3CCN(CC3)C(=O)C)CC

InChI

InChI=1S/C23H31FN4O3/c1-5-7-15(3)25-23(31)18-14-26(6-2)20-13-21(19(24)12-17(20)22(18)30)28-10-8-27(9-11-28)16(4)29/h12-15H,5-11H2,1-4H3,(H,25,31)/t15-/m0/s1