1-[3-fluoranyl-4-[4-[2-(4-methoxyphenyl)quinolin-4-yl]carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[3-fluoranyl-4-[4-[2-(4-methoxyphenyl)quinolin-4-yl]carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[3-fluoro-4-[4-[2-(4-methoxyphenyl)quinoline-4-carbonyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[3-fluoro-4-[4-[[2-(4-methoxyphenyl)-4-quinolinyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[3-fluoro-4-[4-[2-(4-methoxyphenyl)quinoline-4-carbonyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[3-fluoro-4-[4-[2-(4-methoxyphenyl)quinoline-4-carbonyl]piperazino]phenyl]ethanone Formula: C29H26FN3O3 MolecularWeight: 483.533443

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)OC)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)OC)F

InChI

InChI=1S/C29H26FN3O3/c1-19(34)21-9-12-28(25(30)17-21)32-13-15-33(16-14-32)29(35)24-18-27(20-7-10-22(36-2)11-8-20)31-26-6-4-3-5-23(24)26/h3-12,17-18H,13-16H2,1-2H3