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

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-7-(4-ethanoylpiperazin-1-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 7-(4-acetylpiperazin-1-yl)-N-(4-bromo-2-methyl-phenyl)-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxamide CAS Name: 7-(4-acetyl-1-piperazinyl)-N-(4-bromo-2-methylphenyl)-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxamide IUPAC Name: 7-(4-acetylpiperazin-1-yl)-N-(4-bromo-2-methylphenyl)-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxamide Traditional Name: 7-(4-acetylpiperazino)-N-(4-bromo-2-methyl-phenyl)-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxamide Formula: C25H26BrFN4O3 MolecularWeight: 529.401343

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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)NC4=C(C=C(C=C4)Br)C

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C)F)C(=O)NC4=C(C=C(C=C4)Br)C

InChI

InChI=1S/C25H26BrFN4O3/c1-4-29-14-19(25(34)28-21-6-5-17(26)11-15(21)2)24(33)18-12-20(27)23(13-22(18)29)31-9-7-30(8-10-31)16(3)32/h5-6,11-14H,4,7-10H2,1-3H3,(H,28,34)