(6-fluoranyl-2-phenyl-quinolin-4-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: (6-fluoranyl-2-phenyl-quinolin-4-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-(6-fluoro-2-phenyl-4-quinolyl)methanone CAS Name: (6-fluoro-2-phenyl-4-quinolinyl)-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-(6-fluoro-2-phenylquinolin-4-yl)methanone Traditional Name: (4-benzylpiperazino)-(6-fluoro-2-phenyl-4-quinolyl)methanone Formula: C27H24FN3O MolecularWeight: 425.497363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H24FN3O/c28-22-11-12-25-23(17-22)24(18-26(29-25)21-9-5-2-6-10-21)27(32)31-15-13-30(14-16-31)19-20-7-3-1-4-8-20/h1-12,17-18H,13-16,19H2