(4-quinolin-2-ylcarbonylpiperazin-1-yl)-[3-(trifluoromethyl)phenyl]methanone

Systemtic Name: (4-quinolin-2-ylcarbonylpiperazin-1-yl)-[3-(trifluoromethyl)phenyl]methanone Openeye Name: [4-(quinoline-2-carbonyl)piperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone CAS Name: [4-[oxo(2-quinolinyl)methyl]-1-piperazinyl]-[3-(trifluoromethyl)phenyl]methanone IUPAC Name: [4-(quinoline-2-carbonyl)piperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone Traditional Name: (4-quinaldoylpiperazino)-[3-(trifluoromethyl)phenyl]methanone Formula: C22H18F3N3O2 MolecularWeight: 413.39243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=CC=C2)C(F)(F)F)C(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=CC=C2)C(F)(F)F)C(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H18F3N3O2/c23-22(24,25)17-6-3-5-16(14-17)20(29)27-10-12-28(13-11-27)21(30)19-9-8-15-4-1-2-7-18(15)26-19/h1-9,14H,10-13H2