1-[4-[4-[6-bromanyl-2-(4-chlorophenyl)quinolin-4-yl]carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[6-bromanyl-2-(4-chlorophenyl)quinolin-4-yl]carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[6-bromo-2-(4-chlorophenyl)quinoline-4-carbonyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[[6-bromo-2-(4-chlorophenyl)-4-quinolinyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[6-bromo-2-(4-chlorophenyl)quinoline-4-carbonyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[6-bromo-2-(4-chlorophenyl)quinoline-4-carbonyl]piperazino]phenyl]ethanone Formula: C28H23BrClN3O2 MolecularWeight: 548.85812

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H23BrClN3O2/c1-18(34)19-4-9-23(10-5-19)32-12-14-33(15-13-32)28(35)25-17-27(20-2-7-22(30)8-3-20)31-26-11-6-21(29)16-24(25)26/h2-11,16-17H,12-15H2,1H3