(6-bromanyl-2-phenyl-quinolin-4-yl)-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (6-bromanyl-2-phenyl-quinolin-4-yl)-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]methanone Openeye Name: (6-bromo-2-phenyl-4-quinolyl)-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]methanone CAS Name: (6-bromo-2-phenyl-4-quinolinyl)-[4-[(4-fluorophenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (6-bromo-2-phenylquinolin-4-yl)-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]methanone Traditional Name: (6-bromo-2-phenyl-4-quinolyl)-[4-(4-fluorobenzyl)piperazino]methanone Formula: C27H23BrFN3O MolecularWeight: 504.393423

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)F)C(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)F)C(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C27H23BrFN3O/c28-21-8-11-25-23(16-21)24(17-26(30-25)20-4-2-1-3-5-20)27(33)32-14-12-31(13-15-32)18-19-6-9-22(29)10-7-19/h1-11,16-17H,12-15,18H2