1-[6-bromanyl-2-(4-methylpiperazin-1-yl)-4-phenyl-quinolin-3-yl]ethanone

Systemtic Name: 1-[6-bromanyl-2-(4-methylpiperazin-1-yl)-4-phenyl-quinolin-3-yl]ethanone Openeye Name: 1-[6-bromo-2-(4-methylpiperazin-1-yl)-4-phenyl-3-quinolyl]ethanone CAS Name: 1-[6-bromo-2-(4-methyl-1-piperazinyl)-4-phenyl-3-quinolinyl]ethanone IUPAC Name: 1-[6-bromo-2-(4-methylpiperazin-1-yl)-4-phenylquinolin-3-yl]ethanone Traditional Name: 1-[6-bromo-2-(4-methylpiperazino)-4-phenyl-3-quinolyl]ethanone Formula: C22H22BrN3O MolecularWeight: 424.33358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N=C2C=CC(=CC2=C1C3=CC=CC=C3)Br)N4CCN(CC4)C

Isomeric SMILES

CC(=O)C1=C(N=C2C=CC(=CC2=C1C3=CC=CC=C3)Br)N4CCN(CC4)C

InChI

InChI=1S/C22H22BrN3O/c1-15(27)20-21(16-6-4-3-5-7-16)18-14-17(23)8-9-19(18)24-22(20)26-12-10-25(2)11-13-26/h3-9,14H,10-13H2,1-2H3